NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
408637 |
1yzs   |
6590 | cing | 4-filtered-FRED | Wattos | check | violation | distance |
data_1yzs
save_distance_constraint_statistics_1
_Distance_constraint_stats_list.Sf_category distance_constraint_statistics
_Distance_constraint_stats_list.Constraint_list_ID 1
_Distance_constraint_stats_list.Constraint_count 1761
_Distance_constraint_stats_list.Viol_count 9567
_Distance_constraint_stats_list.Viol_total 21344.770
_Distance_constraint_stats_list.Viol_max 1.467
_Distance_constraint_stats_list.Viol_rms 0.0888
_Distance_constraint_stats_list.Viol_average_all_restraints 0.0303
_Distance_constraint_stats_list.Viol_average_violations_only 0.1116
_Distance_constraint_stats_list.Cutoff_violation_report 0.500
_Distance_constraint_stats_list.Details
;
Description of the tags in this list:
* 1 * Administrative tag
* 2 * Administrative tag
* 3 * Administrative tag
* 4 * ID of the restraint list.
* 5 * Number of restraints in list.
* 6 * Number of violated restraints (each model violation is used).
* 7 * Sum of violations in Angstrom.
* 8 * Maximum violation of a restraint without averaging in any way.
* 9 * Rms of violations over all restraints.
* 10 * Average violation over all restraints.
* 11 * Average violation over violated restraints.
This violation is averaged over only those models in which the restraint is violated.
These definitions are from: Doreleijers, et al., J. Mol. Biol. 281, 149-164 (1998).
* 12 * Threshold for reporting violations (in Angstrom) in the last columns of the next table.
* 13 * This tag
Description of the tags in the per residue table below:
* 1 * Chain identifier (can be absent if none defined)
* 2 * Residue number
* 3 * Residue name
* 4 * Maximum violation in ensemble of models (without any averaging)
* 5 * Model number with the maximum violation
* 6 * Number of models with a violation above cutoff
* 7 * List of models (1 character per model) with a violation above cutoff.
An '*' marks a violation above the cutoff. A '+' indicates the largest
violation above the cutoff and a '-' marks the smallest violation over cutoff.
For models 5, 15, 25,... a ' ' is replaced by a '.'.
For models 10, 20, 30,... a ' ' is replaced by a digit starting at 1.
* 8 * Administrative tag
* 9 * Administrative tag
Description of the tags in the per restraint table below:
* 1 * Restraint ID within restraint list.
First node, FIRST member, first atom's:
* 2 * Chain identifier (can be absent if none defined)
* 3 * Residue number
* 4 * Residue name
* 5 * Name of (pseudo-)atom
First node, SECOND member, first atom's:
* 6 * Chain identifier (can be absent if none defined)
* 7 * Residue number
* 8 * Residue name
* 9 * Name of (pseudo-)atom
FIRST node's:
* 10 * Target distance value (Angstrom)
* 11 * Lower bound distance (Angstrom)
* 12 * Upper bound distance (Angstrom)
* 13 * Average distance in ensemble of models
* 14 * Minimum distance in ensemble of models
* 15 * Maximum distance in ensemble of models
* 16 * Maximum violation (without any averaging)
* 17 * Model number with the maximum violation
* 18 * Number of models with a violation above cutoff
* 19 * List of models with a violation above cutoff. See description above.
* 20 * Administrative tag
* 21 * Administrative tag
;
loop_
_Distance_constraint_stats_per_res.Atom_entity_assembly_ID
_Distance_constraint_stats_per_res.Atom_comp_index_ID
_Distance_constraint_stats_per_res.Atom_comp_ID
_Distance_constraint_stats_per_res.Total_violation
_Distance_constraint_stats_per_res.Max_violation
_Distance_constraint_stats_per_res.Max_violation_model_number
_Distance_constraint_stats_per_res.Over_cutoff_viol_count
_Distance_constraint_stats_per_res.Over_cutoff_viol_per_model
1 21 ARG 2.851 0.405 19 0 "[ . 1 . 2]"
1 22 ILE 10.834 0.771 11 1 "[ . 1+ . 2]"
1 23 ALA 8.451 0.771 11 1 "[ . 1+ . 2]"
1 24 ALA 6.465 0.217 11 0 "[ . 1 . 2]"
1 25 VAL 17.636 0.483 12 0 "[ . 1 . 2]"
1 26 HIS 21.935 0.369 8 0 "[ . 1 . 2]"
1 27 ASN 19.928 0.453 1 0 "[ . 1 . 2]"
1 28 VAL 39.108 0.695 14 20 [*************+****-*]
1 29 PRO 6.894 0.204 20 0 "[ . 1 . 2]"
1 30 LEU 70.446 1.104 15 20 [************-*+*****]
1 31 SER 25.660 0.748 12 15 "[***** ***+* .***-*]"
1 32 VAL 59.013 0.748 12 20 [***********+******-*]
1 33 LEU 71.291 1.104 15 20 [************-*+*****]
1 34 ILE 20.241 0.468 10 0 "[ . 1 . 2]"
1 35 ARG 18.762 0.797 9 7 "[ *. *+* -*. * 2]"
1 36 PRO 9.214 0.214 8 0 "[ . 1 . 2]"
1 37 LEU 18.939 0.653 6 10 "[-* .+ * 1* * * ***]"
1 38 PRO 1.097 0.198 9 0 "[ . 1 . 2]"
1 39 SER 0.460 0.034 2 0 "[ . 1 . 2]"
1 40 VAL 11.502 0.460 18 0 "[ . 1 . 2]"
1 41 LEU 23.321 0.460 18 0 "[ . 1 . 2]"
1 42 ASP 20.810 0.267 19 0 "[ . 1 . 2]"
1 43 PRO 7.641 0.224 9 0 "[ . 1 . 2]"
1 44 ALA 10.769 0.224 9 0 "[ . 1 . 2]"
1 45 LYS 16.651 0.817 17 1 "[ . 1 . + 2]"
1 46 VAL 22.143 0.821 12 6 "[* -*. 1*+ . * 2]"
1 47 GLN 9.374 0.821 12 6 "[* -*. 1*+ . * 2]"
1 48 SER 6.750 0.662 10 1 "[ . + . 2]"
1 49 LEU 19.776 0.318 15 0 "[ . 1 . 2]"
1 50 VAL 16.203 0.661 14 3 "[ * . - 1 +. 2]"
1 51 ASP 20.003 0.662 10 1 "[ . + . 2]"
1 52 THR 15.489 0.844 6 7 "[ * .+- *1* . * *]"
1 53 ILE 9.432 0.217 20 0 "[ . 1 . 2]"
1 54 ARG 13.276 0.389 14 0 "[ . 1 . 2]"
1 55 GLU 15.003 0.389 14 0 "[ . 1 . 2]"
1 56 ASP 12.252 0.751 6 4 "[ .+- *1 . *]"
1 57 PRO 5.514 0.176 20 0 "[ . 1 . 2]"
1 58 ASP 2.812 0.176 20 0 "[ . 1 . 2]"
1 59 SER 7.978 0.844 6 4 "[ - .+ 1* . * 2]"
1 60 VAL 28.053 0.803 13 19 "[*** -*******+*******]"
1 61 PRO 5.886 0.588 14 2 "[ .- 1 +. 2]"
1 62 PRO 20.310 0.483 12 0 "[ . 1 . 2]"
1 63 ILE 22.780 0.381 17 0 "[ . 1 . 2]"
1 64 ASP 12.541 0.628 18 1 "[ . 1 . + 2]"
1 65 VAL 30.261 0.539 3 2 "[ + . 1 . - 2]"
1 66 LEU 17.907 0.204 5 0 "[ . 1 . 2]"
1 67 TRP 51.294 0.836 17 2 "[ *. 1 . + 2]"
1 68 ILE 21.933 0.285 10 0 "[ . 1 . 2]"
1 69 LYS 27.441 0.836 17 7 "[* -*.* 1** . + 2]"
1 70 GLY 5.640 0.119 17 0 "[ . 1 . 2]"
1 71 ALA 9.627 0.138 1 0 "[ . 1 . 2]"
1 72 GLN 13.841 0.300 14 0 "[ . 1 . 2]"
1 73 GLY 5.499 0.732 6 5 "[* - .+ 1** . 2]"
1 74 GLY 14.543 0.265 16 0 "[ . 1 . 2]"
1 75 ASP 25.981 0.514 6 2 "[- .+ 1 . 2]"
1 76 TYR 36.012 0.441 14 0 "[ . 1 . 2]"
1 77 PHE 45.266 0.514 6 2 "[- .+ 1 . 2]"
1 78 TYR 30.585 0.468 10 0 "[ . 1 . 2]"
1 79 SER 4.964 0.244 18 0 "[ . 1 . 2]"
1 80 PHE 40.731 0.653 6 10 "[-* .+ * 1* * * ***]"
1 81 GLY 15.186 0.369 12 0 "[ . 1 . 2]"
1 82 GLY 11.378 0.381 17 0 "[ . 1 . 2]"
1 83 CYS 18.030 0.385 16 0 "[ . 1 . 2]"
1 84 HIS 29.920 0.448 17 0 "[ . 1 . 2]"
1 85 ARG 9.132 0.438 17 0 "[ . 1 . 2]"
1 86 TYR 46.501 0.877 3 14 "[ +*.* *****-*. ****]"
1 87 ALA 19.120 0.553 19 4 "[ - 1* . +*]"
1 88 ALA 2.216 0.132 1 0 "[ . 1 . 2]"
1 89 TYR 18.382 0.594 15 3 "[ . 1 + *-]"
1 90 GLN 66.850 1.467 14 19 "[****-****** *+******]"
1 91 GLN 15.239 0.661 14 4 "[-* . * 1 +. 2]"
1 92 LEU 9.417 0.503 13 1 "[ . 1 + . 2]"
1 93 GLN 7.248 0.366 13 0 "[ . 1 . 2]"
1 94 ARG 9.193 0.226 13 0 "[ . 1 . 2]"
1 95 GLU 12.898 0.476 16 0 "[ . 1 . 2]"
1 96 THR 30.457 0.272 20 0 "[ . 1 . 2]"
1 97 ILE 28.838 0.594 15 3 "[ . 1 + *-]"
1 98 PRO 9.835 0.542 16 7 "[ -*. * *** .+ 2]"
1 99 ALA 16.244 0.542 16 7 "[ -*. * *** .+ 2]"
1 100 LYS 19.470 0.468 20 0 "[ . 1 . 2]"
1 101 LEU 26.736 0.395 11 0 "[ . 1 . 2]"
1 102 VAL 22.206 0.539 3 2 "[ + . 1 . - 2]"
1 103 GLN 41.598 1.209 10 20 [*********+-*********]
1 104 SER 29.472 1.209 10 20 [**-******+**********]
1 105 THR 9.604 0.488 13 0 "[ . 1 . 2]"
1 106 LEU 29.003 0.632 10 5 "[ . * + * - * 2]"
1 107 SER 9.080 0.453 20 0 "[ . 1 . 2]"
1 108 ASP 14.425 0.531 6 2 "[ .+ 1 - . 2]"
1 109 LEU 26.568 0.829 17 1 "[ . 1 . + 2]"
1 110 ARG 19.672 0.871 8 8 "[ - * *+*1 **. *]"
1 111 VAL 17.542 0.665 9 3 "[ - . +1 *. 2]"
1 112 TYR 12.231 0.184 3 0 "[ . 1 . 2]"
1 113 LEU 28.140 0.525 17 1 "[ . 1 . + 2]"
1 114 GLY 22.683 0.777 5 8 "[ * + ***1 -*. *]"
1 115 ALA 5.567 0.147 7 0 "[ . 1 . 2]"
1 116 SER 4.632 0.525 17 1 "[ . 1 . + 2]"
1 117 THR 20.187 0.632 10 5 "[ . * + * - * 2]"
1 118 PRO 13.349 0.829 17 1 "[ . 1 . + 2]"
1 119 ASP 15.541 0.368 10 0 "[ . 1 . 2]"
1 120 LEU 28.499 0.829 17 1 "[ . 1 . + 2]"
1 121 GLN 13.384 0.142 7 0 "[ . 1 . 2]"
stop_
loop_
_Distance_constraint_stats.Restraint_ID
_Distance_constraint_stats.Atom_1_entity_assembly_ID
_Distance_constraint_stats.Atom_1_comp_index_ID
_Distance_constraint_stats.Atom_1_comp_ID
_Distance_constraint_stats.Atom_1_ID
_Distance_constraint_stats.Atom_2_entity_assembly_ID
_Distance_constraint_stats.Atom_2_comp_index_ID
_Distance_constraint_stats.Atom_2_comp_ID
_Distance_constraint_stats.Atom_2_ID
_Distance_constraint_stats.Node_1_distance_val
_Distance_constraint_stats.Node_1_distance_lower_bound_val
_Distance_constraint_stats.Node_1_distance_upper_bound_val
_Distance_constraint_stats.Distance_average
_Distance_constraint_stats.Distance_minimum
_Distance_constraint_stats.Distance_maximum
_Distance_constraint_stats.Max_violation
_Distance_constraint_stats.Max_violation_model_number
_Distance_constraint_stats.Over_cutoff_violation_count
_Distance_constraint_stats.Over_cutoff_viol_per_model
_Distance_constraint_stats.Distance_constraint_stats_ID
1 1 21 ARG HA 1 22 ILE H 2.273 2.256 2.649 2.345 2.205 2.689 0.051 7 0 "[ . 1 . 2]" 1
2 1 21 ARG HB2 1 22 ILE H 2.513 2.157 2.928 2.645 2.107 2.849 0.050 15 0 "[ . 1 . 2]" 1
3 1 21 ARG HB2 1 67 TRP HH2 5.031 4.199 6.048 5.347 5.011 5.720 . 0 0 "[ . 1 . 2]" 1
4 1 21 ARG HB2 1 67 TRP HZ3 4.756 3.970 5.717 4.120 3.917 4.313 0.053 15 0 "[ . 1 . 2]" 1
5 1 21 ARG HB3 1 22 ILE H 4.312 3.701 5.025 3.920 3.296 4.606 0.405 19 0 "[ . 1 . 2]" 1
6 1 21 ARG QD 1 67 TRP HE3 3.258 2.719 3.917 2.638 2.624 2.655 0.095 6 0 "[ . 1 . 2]" 1
7 1 21 ARG QG 1 67 TRP HH2 4.979 4.156 5.985 5.700 4.920 6.103 0.118 17 0 "[ . 1 . 2]" 1
8 1 21 ARG QG 1 67 TRP HZ2 4.791 3.999 5.759 4.911 4.815 5.012 . 0 0 "[ . 1 . 2]" 1
9 1 22 ILE H 1 22 ILE MD 5.300 4.344 6.467 4.322 4.186 4.345 0.158 11 0 "[ . 1 . 2]" 1
10 1 22 ILE H 1 22 ILE HG12 3.344 2.870 3.897 3.854 2.812 3.919 0.058 11 0 "[ . 1 . 2]" 1
11 1 22 ILE H 1 22 ILE HG13 3.404 2.921 3.967 3.020 2.785 3.048 0.136 11 0 "[ . 1 . 2]" 1
12 1 22 ILE H 1 22 ILE MG 3.482 2.988 4.058 3.950 3.518 3.977 . 0 0 "[ . 1 . 2]" 1
13 1 22 ILE H 1 22 ILE MG 3.824 3.134 4.666 3.410 3.124 3.613 0.010 3 0 "[ . 1 . 2]" 1
14 1 22 ILE H 1 23 ALA H 4.069 3.492 4.742 3.793 3.762 4.090 . 0 0 "[ . 1 . 2]" 1
15 1 22 ILE H 1 23 ALA H 3.859 3.312 4.497 3.510 3.155 3.616 0.157 11 0 "[ . 1 . 2]" 1
16 1 22 ILE H 1 23 ALA MB 3.936 3.376 4.588 4.499 4.174 4.643 0.055 11 0 "[ . 1 . 2]" 1
17 1 22 ILE H 1 23 ALA MB 3.028 2.482 3.694 3.369 3.185 3.580 . 0 0 "[ . 1 . 2]" 1
18 1 22 ILE HA 1 22 ILE MD 3.573 2.929 4.360 3.765 3.742 4.156 . 0 0 "[ . 1 . 2]" 1
19 1 22 ILE HA 1 22 ILE MG 2.787 2.558 3.400 2.411 2.243 2.434 0.315 11 0 "[ . 1 . 2]" 1
20 1 22 ILE HA 1 23 ALA H . 2.208 2.542 2.223 2.150 2.230 0.058 11 0 "[ . 1 . 2]" 1
21 1 22 ILE HA 1 23 ALA MB 3.835 3.571 4.679 4.130 3.996 4.160 . 0 0 "[ . 1 . 2]" 1
22 1 22 ILE HB 1 23 ALA H 3.994 3.428 4.654 4.387 3.379 4.449 0.049 11 0 "[ . 1 . 2]" 1
23 1 22 ILE MD 1 23 ALA MB 3.158 2.588 3.853 3.932 3.871 4.071 0.218 11 0 "[ . 1 . 2]" 1
24 1 22 ILE MD 1 101 LEU MD1 4.500 4.000 1003.500 5.287 3.988 5.738 0.012 11 0 "[ . 1 . 2]" 1
25 1 22 ILE MD 1 101 LEU MD2 4.500 4.000 1003.500 7.054 6.021 7.455 . 0 0 "[ . 1 . 2]" 1
26 1 22 ILE MD 1 23 ALA MB 4.217 3.456 5.145 4.732 3.448 5.164 0.019 17 0 "[ . 1 . 2]" 1
27 1 22 ILE HG12 1 23 ALA H 3.898 3.345 4.543 4.691 4.626 5.314 0.771 11 1 "[ . 1+ . 2]" 1
28 1 22 ILE MG 1 23 ALA H 4.158 3.408 5.073 3.396 3.345 3.789 0.063 17 0 "[ . 1 . 2]" 1
29 1 22 ILE MG 1 23 ALA H 3.127 2.684 3.644 3.392 3.342 3.779 0.135 11 0 "[ . 1 . 2]" 1
30 1 22 ILE MG 1 24 ALA H 3.741 3.210 4.359 3.777 3.268 4.576 0.217 11 0 "[ . 1 . 2]" 1
31 1 22 ILE MG 1 67 TRP HZ3 4.788 3.997 5.756 5.647 5.010 5.790 0.034 15 0 "[ . 1 . 2]" 1
32 1 23 ALA H 1 23 ALA HA . 2.965 3.279 2.978 2.955 3.009 0.010 19 0 "[ . 1 . 2]" 1
33 1 23 ALA H 1 23 ALA MB 2.490 2.137 2.902 2.276 2.232 2.398 . 0 0 "[ . 1 . 2]" 1
34 1 23 ALA H 1 24 ALA H 3.706 3.181 4.319 4.191 3.282 4.365 0.046 6 0 "[ . 1 . 2]" 1
35 1 23 ALA HA 1 24 ALA H 2.329 . 2.714 2.250 2.183 2.632 . 0 0 "[ . 1 . 2]" 1
36 1 23 ALA HA 1 24 ALA MB 3.557 2.915 4.340 4.137 4.014 4.474 0.134 11 0 "[ . 1 . 2]" 1
37 1 23 ALA HA 1 67 TRP HE3 3.869 3.229 4.651 3.277 3.192 3.326 0.037 12 0 "[ . 1 . 2]" 1
38 1 23 ALA HA 1 67 TRP HZ3 4.861 4.058 5.843 4.382 4.286 4.513 . 0 0 "[ . 1 . 2]" 1
39 1 23 ALA MB 1 24 ALA H 2.372 2.036 2.764 2.585 2.368 2.642 . 0 0 "[ . 1 . 2]" 1
40 1 23 ALA MB 1 24 ALA HA 3.384 2.774 4.129 3.267 3.228 3.306 . 0 0 "[ . 1 . 2]" 1
41 1 23 ALA MB 1 67 TRP HE3 3.304 2.758 3.972 2.900 2.839 2.947 . 0 0 "[ . 1 . 2]" 1
42 1 23 ALA MB 1 67 TRP HE3 4.124 3.380 5.032 5.087 5.067 5.113 0.081 11 0 "[ . 1 . 2]" 1
43 1 23 ALA MB 1 67 TRP HZ3 4.172 3.482 5.015 4.328 4.270 4.413 . 0 0 "[ . 1 . 2]" 1
44 1 23 ALA MB 1 102 VAL HA 4.000 3.500 1003.000 3.435 3.394 3.469 0.106 20 0 "[ . 1 . 2]" 1
45 1 23 ALA MB 1 103 GLN QB 4.500 4.000 1003.500 4.147 3.945 4.289 0.055 13 0 "[ . 1 . 2]" 1
46 1 24 ALA H 1 24 ALA HA 3.547 2.907 4.328 2.970 2.947 2.999 . 0 0 "[ . 1 . 2]" 1
47 1 24 ALA H 1 24 ALA HA 2.690 2.309 3.135 2.964 2.939 2.995 . 0 0 "[ . 1 . 2]" 1
48 1 24 ALA H 1 24 ALA MB 3.048 2.498 3.719 2.669 2.395 2.745 0.103 11 0 "[ . 1 . 2]" 1
49 1 24 ALA H 1 25 VAL H 3.849 3.303 4.367 4.394 4.384 4.444 0.077 11 0 "[ . 1 . 2]" 1
50 1 24 ALA H 1 101 LEU H 4.500 4.000 5.000 3.938 3.901 4.357 0.099 20 0 "[ . 1 . 2]" 1
51 1 24 ALA HA 1 25 VAL H 2.410 2.068 2.808 2.686 2.675 2.699 . 0 0 "[ . 1 . 2]" 1
52 1 24 ALA MB 1 25 VAL H 2.725 2.339 3.176 2.249 2.239 2.260 0.100 11 0 "[ . 1 . 2]" 1
53 1 24 ALA MB 1 26 HIS HD2 3.357 2.802 4.036 2.713 2.690 2.726 0.112 10 0 "[ . 1 . 2]" 1
54 1 24 ALA MB 1 26 HIS HE1 4.065 3.393 4.887 4.597 4.271 4.776 . 0 0 "[ . 1 . 2]" 1
55 1 25 VAL H 1 25 VAL HA 3.165 2.716 3.452 2.925 2.907 2.949 . 0 0 "[ . 1 . 2]" 1
56 1 25 VAL H 1 25 VAL HB 2.423 2.080 2.823 2.494 2.440 2.555 . 0 0 "[ . 1 . 2]" 1
57 1 25 VAL H 1 25 VAL MG1 3.697 3.030 4.511 3.786 3.773 3.803 . 0 0 "[ . 1 . 2]" 1
58 1 25 VAL H 1 25 VAL MG2 2.726 2.366 3.177 2.280 2.248 2.309 0.118 20 0 "[ . 1 . 2]" 1
59 1 25 VAL H 1 26 HIS H 3.959 3.745 4.614 4.632 4.615 4.648 0.034 20 0 "[ . 1 . 2]" 1
60 1 25 VAL HA 1 26 HIS H 2.269 . 2.768 2.274 2.257 2.292 . 0 0 "[ . 1 . 2]" 1
61 1 25 VAL HA 1 101 LEU H 3.142 2.575 3.887 3.629 3.319 3.828 . 0 0 "[ . 1 . 2]" 1
62 1 25 VAL HB 1 26 HIS H 3.280 2.815 3.822 3.980 3.937 4.012 0.190 19 0 "[ . 1 . 2]" 1
63 1 25 VAL HB 1 26 HIS HD2 4.208 3.512 5.058 4.009 3.814 4.098 . 0 0 "[ . 1 . 2]" 1
64 1 25 VAL HB 1 99 ALA H 4.046 3.473 4.715 3.867 3.432 4.275 0.041 5 0 "[ . 1 . 2]" 1
65 1 25 VAL QG 1 62 PRO HG2 2.732 2.239 3.333 2.975 2.047 3.398 0.192 19 0 "[ . 1 . 2]" 1
66 1 25 VAL QG 1 62 PRO HG3 2.778 2.277 3.390 2.188 2.098 2.340 0.179 16 0 "[ . 1 . 2]" 1
67 1 25 VAL MG1 1 26 HIS H . 2.526 2.909 2.352 2.334 2.380 0.192 1 0 "[ . 1 . 2]" 1
68 1 25 VAL MG1 1 62 PRO HB2 2.939 2.409 3.586 3.450 3.244 3.757 0.171 19 0 "[ . 1 . 2]" 1
69 1 25 VAL MG1 1 98 PRO HA 3.091 2.849 3.771 3.475 3.285 3.602 . 0 0 "[ . 1 . 2]" 1
70 1 25 VAL MG1 1 99 ALA H 3.057 2.779 3.562 3.140 2.889 3.449 . 0 0 "[ . 1 . 2]" 1
71 1 25 VAL MG2 1 26 HIS H 3.640 2.983 4.441 3.963 3.876 4.052 . 0 0 "[ . 1 . 2]" 1
72 1 25 VAL MG2 1 62 PRO HB2 2.881 2.374 3.500 3.616 3.170 3.983 0.483 12 0 "[ . 1 . 2]" 1
73 1 26 HIS H 1 26 HIS HB2 2.670 2.291 3.111 2.732 2.688 2.754 . 0 0 "[ . 1 . 2]" 1
74 1 26 HIS H 1 26 HIS HB3 3.284 2.818 3.827 3.819 3.798 3.854 0.027 10 0 "[ . 1 . 2]" 1
75 1 26 HIS H 1 26 HIS HD2 3.889 3.338 4.532 3.659 3.494 3.769 . 0 0 "[ . 1 . 2]" 1
76 1 26 HIS H 1 27 ASN H 4.039 3.936 4.707 4.383 4.274 4.437 . 0 0 "[ . 1 . 2]" 1
77 1 26 HIS H 1 81 GLY H 4.089 3.509 4.765 4.395 4.359 4.423 . 0 0 "[ . 1 . 2]" 1
78 1 26 HIS H 1 98 PRO HA 3.427 2.941 3.994 4.039 3.920 4.087 0.093 2 0 "[ . 1 . 2]" 1
79 1 26 HIS H 1 99 ALA H 3.185 2.733 3.397 2.779 2.681 2.942 0.052 6 0 "[ . 1 . 2]" 1
80 1 26 HIS H 1 99 ALA H 3.185 2.733 3.711 2.747 2.653 2.900 0.080 6 0 "[ . 1 . 2]" 1
81 1 26 HIS H 1 101 LEU H 3.417 2.933 3.982 3.691 3.521 3.767 . 0 0 "[ . 1 . 2]" 1
82 1 26 HIS H 1 101 LEU H 4.268 3.663 4.973 4.257 3.910 4.429 . 0 0 "[ . 1 . 2]" 1
83 1 26 HIS H 1 101 LEU MD1 4.244 3.642 4.946 4.778 4.623 4.917 . 0 0 "[ . 1 . 2]" 1
84 1 26 HIS HA 1 26 HIS HD2 3.476 2.901 4.179 3.679 3.624 3.781 . 0 0 "[ . 1 . 2]" 1
85 1 26 HIS HA 1 27 ASN H 2.642 2.267 3.079 2.316 2.237 2.395 0.030 14 0 "[ . 1 . 2]" 1
86 1 26 HIS HA 1 99 ALA MB 3.736 3.062 4.558 4.548 4.399 4.632 0.074 12 0 "[ . 1 . 2]" 1
87 1 26 HIS HB2 1 26 HIS HD2 3.616 3.018 4.347 2.986 2.975 2.996 0.043 10 0 "[ . 1 . 2]" 1
88 1 26 HIS HB2 1 27 ASN H 2.634 2.261 3.069 3.174 2.900 3.438 0.369 8 0 "[ . 1 . 2]" 1
89 1 26 HIS HB2 1 27 ASN HD21 2.992 2.568 3.487 2.657 2.544 2.773 0.024 16 0 "[ . 1 . 2]" 1
90 1 26 HIS HB2 1 27 ASN HD22 3.412 2.928 3.976 3.659 3.610 3.714 . 0 0 "[ . 1 . 2]" 1
91 1 26 HIS HB2 1 28 VAL H 3.676 3.155 4.284 3.960 3.788 4.171 . 0 0 "[ . 1 . 2]" 1
92 1 26 HIS HB2 1 28 VAL MG1 3.601 2.951 4.394 4.120 4.070 4.185 . 0 0 "[ . 1 . 2]" 1
93 1 26 HIS HB2 1 28 VAL MG2 3.726 3.054 4.546 3.310 3.206 3.439 . 0 0 "[ . 1 . 2]" 1
94 1 26 HIS HB2 1 101 LEU MD1 3.521 2.886 4.296 2.668 2.620 2.727 0.266 5 0 "[ . 1 . 2]" 1
95 1 26 HIS HB2 1 101 LEU MD2 3.893 3.191 4.750 3.284 3.220 3.367 . 0 0 "[ . 1 . 2]" 1
96 1 26 HIS HB3 1 26 HIS HD2 3.892 3.249 4.679 3.986 3.981 3.989 . 0 0 "[ . 1 . 2]" 1
97 1 26 HIS HB3 1 27 ASN H 2.983 2.560 3.476 2.819 2.540 3.252 0.020 12 0 "[ . 1 . 2]" 1
98 1 26 HIS HB3 1 28 VAL MG1 3.399 2.786 4.147 3.922 3.827 4.055 . 0 0 "[ . 1 . 2]" 1
99 1 26 HIS HB3 1 28 VAL MG2 3.563 2.921 4.346 3.121 3.010 3.252 . 0 0 "[ . 1 . 2]" 1
100 1 26 HIS HB3 1 101 LEU MD1 3.515 2.881 4.289 3.170 3.021 3.398 . 0 0 "[ . 1 . 2]" 1
101 1 26 HIS HB3 1 101 LEU MD2 3.518 2.883 4.292 4.123 3.970 4.307 0.015 10 0 "[ . 1 . 2]" 1
102 1 26 HIS HD2 1 101 LEU H 4.350 3.733 4.799 4.037 3.812 4.219 . 0 0 "[ . 1 . 2]" 1
103 1 26 HIS HD2 1 101 LEU MD1 3.589 2.996 4.314 3.475 3.168 3.703 . 0 0 "[ . 1 . 2]" 1
104 1 26 HIS HD2 1 101 LEU MD2 4.338 3.621 5.215 5.018 4.757 5.205 . 0 0 "[ . 1 . 2]" 1
105 1 26 HIS HE1 1 101 LEU MD1 4.688 3.913 5.636 4.511 4.452 4.579 . 0 0 "[ . 1 . 2]" 1
106 1 26 HIS HE1 1 101 LEU MD2 5.653 4.719 6.795 6.897 6.874 6.929 0.134 17 0 "[ . 1 . 2]" 1
107 1 27 ASN H 1 27 ASN HA 3.374 2.896 3.932 2.963 2.926 2.989 . 0 0 "[ . 1 . 2]" 1
108 1 27 ASN H 1 27 ASN HB2 3.145 2.699 3.665 3.028 2.359 3.648 0.340 1 0 "[ . 1 . 2]" 1
109 1 27 ASN H 1 27 ASN HD21 4.476 3.841 5.216 4.200 4.100 4.292 . 0 0 "[ . 1 . 2]" 1
110 1 27 ASN H 1 27 ASN HD22 3.873 3.324 4.513 4.194 3.826 4.611 0.098 5 0 "[ . 1 . 2]" 1
111 1 27 ASN H 1 28 VAL H 4.158 3.568 4.845 4.125 4.031 4.212 . 0 0 "[ . 1 . 2]" 1
112 1 27 ASN HA 1 27 ASN HD21 4.265 3.660 4.970 4.575 4.439 4.693 . 0 0 "[ . 1 . 2]" 1
113 1 27 ASN HA 1 27 ASN HD22 4.422 3.795 5.153 4.974 4.546 5.358 0.205 16 0 "[ . 1 . 2]" 1
114 1 27 ASN HA 1 28 VAL H 2.247 . 2.618 2.272 2.259 2.289 . 0 0 "[ . 1 . 2]" 1
115 1 27 ASN HA 1 98 PRO HA 2.536 2.078 3.045 2.478 2.344 2.657 . 0 0 "[ . 1 . 2]" 1
116 1 27 ASN HA 1 99 ALA H . 3.375 3.654 3.653 3.493 3.719 0.065 19 0 "[ . 1 . 2]" 1
117 1 27 ASN HA 1 99 ALA MB 3.459 2.835 4.220 4.141 4.007 4.236 0.016 3 0 "[ . 1 . 2]" 1
118 1 27 ASN HB2 1 27 ASN HD21 3.284 2.818 3.827 2.660 2.548 2.775 0.270 8 0 "[ . 1 . 2]" 1
119 1 27 ASN HB2 1 27 ASN HD22 3.680 3.158 4.288 3.667 3.618 3.714 . 0 0 "[ . 1 . 2]" 1
120 1 27 ASN HB2 1 28 VAL H 3.488 2.993 4.065 4.237 3.945 4.518 0.453 1 0 "[ . 1 . 2]" 1
121 1 27 ASN HD21 1 32 VAL QG 4.683 4.019 5.457 4.399 4.233 4.616 . 0 0 "[ . 1 . 2]" 1
122 1 27 ASN HD21 1 96 THR HB 4.105 3.523 4.784 4.802 4.559 4.826 0.042 2 0 "[ . 1 . 2]" 1
123 1 27 ASN HD22 1 32 VAL QG 5.498 4.718 6.407 5.211 4.689 5.775 0.029 10 0 "[ . 1 . 2]" 1
124 1 27 ASN HD22 1 96 THR HB 4.836 4.150 5.635 5.700 5.668 5.845 0.210 8 0 "[ . 1 . 2]" 1
125 1 28 VAL H 1 28 VAL HA 2.964 2.544 3.454 2.937 2.912 2.953 . 0 0 "[ . 1 . 2]" 1
126 1 28 VAL H 1 28 VAL HB 2.664 2.286 3.104 2.541 2.488 2.580 . 0 0 "[ . 1 . 2]" 1
127 1 28 VAL H 1 28 VAL MG1 2.852 2.337 3.480 2.239 2.212 2.264 0.125 20 0 "[ . 1 . 2]" 1
128 1 28 VAL H 1 28 VAL MG1 2.590 2.223 3.018 2.207 2.185 2.228 0.038 20 0 "[ . 1 . 2]" 1
129 1 28 VAL H 1 28 VAL MG2 3.471 2.845 4.217 3.808 3.790 3.824 . 0 0 "[ . 1 . 2]" 1
130 1 28 VAL H 1 32 VAL QG 3.822 3.280 4.454 4.502 4.448 4.542 0.088 6 0 "[ . 1 . 2]" 1
131 1 28 VAL H 1 96 THR HB 3.260 2.798 3.799 3.862 3.808 3.891 0.092 16 0 "[ . 1 . 2]" 1
132 1 28 VAL H 1 97 ILE H 2.834 2.495 3.302 3.392 3.380 3.409 0.107 10 0 "[ . 1 . 2]" 1
133 1 28 VAL H 1 97 ILE MG 3.324 2.724 4.056 3.352 3.243 3.467 . 0 0 "[ . 1 . 2]" 1
134 1 28 VAL H 1 98 PRO HA 3.224 2.767 3.757 3.627 3.441 3.866 0.109 8 0 "[ . 1 . 2]" 1
135 1 28 VAL H 1 99 ALA H 3.776 3.307 4.400 3.645 3.444 3.835 . 0 0 "[ . 1 . 2]" 1
136 1 28 VAL H 1 99 ALA MB 3.992 3.426 4.652 3.619 3.389 3.865 0.037 2 0 "[ . 1 . 2]" 1
137 1 28 VAL HA 1 28 VAL MG1 2.938 2.408 3.585 3.200 3.196 3.204 . 0 0 "[ . 1 . 2]" 1
138 1 28 VAL HA 1 28 VAL MG2 2.829 2.319 3.452 2.258 2.245 2.270 0.074 18 0 "[ . 1 . 2]" 1
139 1 28 VAL HA 1 29 PRO HD2 2.551 2.091 3.112 2.482 2.428 2.540 . 0 0 "[ . 1 . 2]" 1
140 1 28 VAL HA 1 29 PRO HD3 2.275 . 2.776 2.235 2.221 2.263 . 0 0 "[ . 1 . 2]" 1
141 1 28 VAL HA 1 99 ALA H 4.024 3.453 4.690 4.827 4.747 4.905 0.215 15 0 "[ . 1 . 2]" 1
142 1 28 VAL HA 1 99 ALA MB 3.520 2.885 4.295 4.236 4.129 4.340 0.045 8 0 "[ . 1 . 2]" 1
143 1 28 VAL HB 1 99 ALA MB 3.481 2.853 4.247 3.383 3.101 3.589 . 0 0 "[ . 1 . 2]" 1
144 1 28 VAL QG 1 32 VAL QG . 2.887 3.371 2.234 2.192 2.285 0.695 14 20 [*************+****-*] 1
145 1 28 VAL QG 1 99 ALA MB 2.466 2.021 3.009 2.300 2.169 2.406 . 0 0 "[ . 1 . 2]" 1
146 1 28 VAL QG 1 99 ALA H 3.738 3.208 4.356 4.094 3.856 4.364 0.008 8 0 "[ . 1 . 2]" 1
147 1 28 VAL MG1 1 29 PRO HD3 3.775 3.094 4.606 4.532 4.518 4.555 . 0 0 "[ . 1 . 2]" 1
148 1 28 VAL MG1 1 32 VAL QG 2.808 2.301 3.426 3.453 3.397 3.489 0.063 8 0 "[ . 1 . 2]" 1
149 1 28 VAL MG1 1 77 PHE QD 3.708 3.095 4.457 4.083 3.982 4.310 . 0 0 "[ . 1 . 2]" 1
150 1 28 VAL MG1 1 99 ALA MB 2.697 2.210 3.291 2.541 2.338 2.644 . 0 0 "[ . 1 . 2]" 1
151 1 28 VAL MG1 1 101 LEU MD1 3.926 3.218 4.791 4.975 4.938 5.028 0.237 5 0 "[ . 1 . 2]" 1
152 1 28 VAL MG2 1 29 PRO HD2 3.137 2.571 3.827 2.458 2.412 2.518 0.159 15 0 "[ . 1 . 2]" 1
153 1 28 VAL MG2 1 29 PRO HD3 3.697 3.030 4.511 3.451 3.386 3.517 . 0 0 "[ . 1 . 2]" 1
154 1 28 VAL MG2 1 32 VAL QG 2.840 2.330 3.470 2.250 2.207 2.304 0.123 14 0 "[ . 1 . 2]" 1
155 1 28 VAL MG2 1 32 VAL QG 2.858 2.342 3.487 2.263 2.218 2.319 0.124 14 0 "[ . 1 . 2]" 1
156 1 28 VAL MG2 1 99 ALA MB 3.394 2.782 4.141 4.165 3.923 4.303 0.162 17 0 "[ . 1 . 2]" 1
157 1 28 VAL MG2 1 101 LEU MD1 3.937 3.226 4.804 3.877 3.747 3.984 . 0 0 "[ . 1 . 2]" 1
158 1 29 PRO HA 1 30 LEU H 2.123 . 2.590 2.224 2.204 2.243 . 0 0 "[ . 1 . 2]" 1
159 1 29 PRO HA 1 96 THR HA 2.178 . 2.595 2.366 2.335 2.427 . 0 0 "[ . 1 . 2]" 1
160 1 29 PRO HB2 1 32 VAL H 3.065 2.630 3.572 2.598 2.426 2.668 0.204 20 0 "[ . 1 . 2]" 1
161 1 29 PRO HB2 1 30 LEU H 3.392 2.911 3.953 3.823 3.754 3.924 . 0 0 "[ . 1 . 2]" 1
162 1 29 PRO HB2 1 31 SER H 3.263 2.800 3.802 3.378 3.180 3.613 . 0 0 "[ . 1 . 2]" 1
163 1 29 PRO HB3 1 30 LEU H 3.178 2.727 3.703 3.324 3.264 3.452 . 0 0 "[ . 1 . 2]" 1
164 1 29 PRO HB3 1 31 SER H 3.696 3.172 4.307 3.305 3.164 3.494 0.008 13 0 "[ . 1 . 2]" 1
165 1 29 PRO HB3 1 96 THR MG 2.613 2.142 3.188 2.856 2.032 3.193 0.110 12 0 "[ . 1 . 2]" 1
166 1 29 PRO HD2 1 32 VAL QG 3.062 2.510 3.736 2.504 2.383 2.614 0.127 20 0 "[ . 1 . 2]" 1
167 1 29 PRO HD3 1 32 VAL QG 3.821 3.132 4.662 3.870 3.753 4.031 . 0 0 "[ . 1 . 2]" 1
168 1 29 PRO HD3 1 96 THR MG 3.650 2.992 4.453 2.892 2.851 2.929 0.141 8 0 "[ . 1 . 2]" 1
169 1 29 PRO HG2 1 32 VAL QG 3.117 2.555 3.803 2.864 2.578 3.155 . 0 0 "[ . 1 . 2]" 1
170 1 29 PRO HG3 1 32 VAL H 4.764 4.088 5.551 5.578 5.401 5.644 0.093 1 0 "[ . 1 . 2]" 1
171 1 29 PRO HG3 1 32 VAL QG 3.500 2.869 4.270 3.960 3.693 4.268 . 0 0 "[ . 1 . 2]" 1
172 1 29 PRO HG3 1 96 THR MG 2.943 2.412 3.591 2.458 2.384 2.696 0.028 2 0 "[ . 1 . 2]" 1
173 1 30 LEU H 1 30 LEU HA 2.644 2.374 3.081 2.875 2.853 2.890 . 0 0 "[ . 1 . 2]" 1
174 1 30 LEU H 1 30 LEU HB2 2.435 2.090 2.838 2.445 2.381 2.488 . 0 0 "[ . 1 . 2]" 1
175 1 30 LEU H 1 30 LEU HB3 2.929 2.514 3.413 3.601 3.589 3.608 0.195 8 0 "[ . 1 . 2]" 1
176 1 30 LEU H 1 30 LEU MD1 3.208 2.630 3.914 3.004 2.917 3.082 . 0 0 "[ . 1 . 2]" 1
177 1 30 LEU H 1 30 LEU MD1 2.680 2.300 3.123 2.961 2.879 3.032 . 0 0 "[ . 1 . 2]" 1
178 1 30 LEU H 1 30 LEU MD2 4.039 3.466 4.707 3.834 3.793 3.935 . 0 0 "[ . 1 . 2]" 1
179 1 30 LEU H 1 30 LEU HG 2.763 2.371 3.220 2.335 2.275 2.493 0.096 14 0 "[ . 1 . 2]" 1
180 1 30 LEU H 1 31 SER H 3.036 2.606 3.411 2.532 2.502 2.564 0.104 6 0 "[ . 1 . 2]" 1
181 1 30 LEU H 1 32 VAL QG 2.763 2.371 3.220 3.284 3.259 3.312 0.092 10 0 "[ . 1 . 2]" 1
182 1 30 LEU H 1 95 GLU HA 4.064 3.488 4.736 4.768 4.722 4.822 0.086 13 0 "[ . 1 . 2]" 1
183 1 30 LEU H 1 96 THR H 4.874 4.183 5.680 4.949 4.905 4.978 . 0 0 "[ . 1 . 2]" 1
184 1 30 LEU H 1 96 THR HA 2.535 2.148 2.917 2.440 2.409 2.462 . 0 0 "[ . 1 . 2]" 1
185 1 30 LEU H 1 96 THR HB 3.973 3.410 4.630 4.647 4.590 4.692 0.062 20 0 "[ . 1 . 2]" 1
186 1 30 LEU H 1 96 THR MG 3.539 2.901 4.318 3.374 3.343 3.406 . 0 0 "[ . 1 . 2]" 1
187 1 30 LEU H 1 97 ILE H 3.884 3.333 4.218 4.295 4.243 4.349 0.131 6 0 "[ . 1 . 2]" 1
188 1 30 LEU H 1 97 ILE MD 3.894 3.192 1002.894 6.287 6.013 6.884 . 0 0 "[ . 1 . 2]" 1
189 1 30 LEU H 1 97 ILE MG 4.033 3.305 1003.033 4.611 4.521 4.838 . 0 0 "[ . 1 . 2]" 1
190 1 30 LEU HA 1 30 LEU MD1 3.051 2.726 3.723 3.864 3.841 3.879 0.156 18 0 "[ . 1 . 2]" 1
191 1 30 LEU HA 1 30 LEU MD2 3.147 2.579 3.809 2.488 2.466 2.517 0.113 16 0 "[ . 1 . 2]" 1
192 1 30 LEU HA 1 31 SER H 3.827 3.137 4.669 3.498 3.456 3.529 . 0 0 "[ . 1 . 2]" 1
193 1 30 LEU HA 1 31 SER H 2.493 2.139 2.905 2.207 2.050 2.560 0.089 3 0 "[ . 1 . 2]" 1
194 1 30 LEU HA 1 32 VAL H 3.817 3.276 4.448 3.171 3.049 3.391 0.227 18 0 "[ . 1 . 2]" 1
195 1 30 LEU HA 1 32 VAL H 3.822 3.133 4.663 3.980 3.798 4.378 . 0 0 "[ . 1 . 2]" 1
196 1 30 LEU HA 1 33 LEU H 3.512 2.878 4.285 3.868 3.386 4.138 . 0 0 "[ . 1 . 2]" 1
197 1 30 LEU HA 1 33 LEU QD . 3.259 3.558 2.239 2.155 2.331 1.104 15 20 [**************+*-***] 1
198 1 30 LEU HA 1 97 ILE MD 2.624 2.151 3.202 2.825 2.455 3.349 0.147 20 0 "[ . 1 . 2]" 1
199 1 30 LEU HA 1 97 ILE MG 3.428 2.810 4.183 3.555 3.411 3.668 . 0 0 "[ . 1 . 2]" 1
200 1 30 LEU HA 1 97 ILE MG 3.428 2.810 4.183 3.646 3.518 3.764 . 0 0 "[ . 1 . 2]" 1
201 1 30 LEU HB2 1 31 SER H 2.934 2.518 3.419 2.707 2.507 2.844 0.011 3 0 "[ . 1 . 2]" 1
202 1 30 LEU HB3 1 31 SER H 3.265 2.802 3.805 3.718 3.556 3.828 0.023 14 0 "[ . 1 . 2]" 1
203 1 30 LEU HB3 1 86 TYR QD 3.737 3.119 4.492 3.408 3.160 3.989 . 0 0 "[ . 1 . 2]" 1
204 1 30 LEU HB3 1 86 TYR QE 3.614 3.017 4.344 3.298 2.952 3.871 0.065 13 0 "[ . 1 . 2]" 1
205 1 30 LEU QD 1 89 TYR H 4.079 3.501 4.753 3.758 3.643 4.185 . 0 0 "[ . 1 . 2]" 1
206 1 30 LEU MD1 1 31 SER H 4.366 3.747 5.088 4.263 4.125 4.383 . 0 0 "[ . 1 . 2]" 1
207 1 30 LEU MD1 1 32 VAL QG 3.304 2.708 4.031 4.185 4.148 4.218 0.187 19 0 "[ . 1 . 2]" 1
208 1 30 LEU MD1 1 86 TYR QD 3.656 3.052 4.395 2.697 2.410 3.243 0.642 8 6 "[ .* +** - . *]" 1
209 1 30 LEU MD1 1 86 TYR QE 3.804 3.175 4.573 2.656 2.298 3.007 0.877 3 9 "[ + .- ***** . * *2]" 1
210 1 30 LEU MD1 1 89 TYR QD 2.767 2.310 3.326 2.443 2.331 2.826 . 0 0 "[ . 1 . 2]" 1
211 1 30 LEU MD1 1 89 TYR QE 3.282 2.739 3.945 3.283 2.976 3.621 . 0 0 "[ . 1 . 2]" 1
212 1 30 LEU MD1 1 90 GLN H 4.305 3.695 4.810 4.734 4.426 4.859 0.049 4 0 "[ . 1 . 2]" 1
213 1 30 LEU MD1 1 90 GLN HA 3.373 2.765 3.910 3.332 3.164 3.540 . 0 0 "[ . 1 . 2]" 1
214 1 30 LEU MD1 1 95 GLU HA 3.512 3.101 4.285 3.086 3.029 3.151 0.072 13 0 "[ . 1 . 2]" 1
215 1 30 LEU MD1 1 96 THR H 4.449 3.818 5.184 3.601 3.546 3.631 0.272 20 0 "[ . 1 . 2]" 1
216 1 30 LEU MD2 1 89 TYR QD 3.021 2.522 3.632 2.663 2.492 2.970 0.030 20 0 "[ . 1 . 2]" 1
217 1 30 LEU MD2 1 89 TYR QE 2.732 2.280 3.284 2.490 2.335 2.770 . 0 0 "[ . 1 . 2]" 1
218 1 30 LEU MD2 1 86 TYR H 4.320 3.707 5.034 4.281 3.996 4.489 . 0 0 "[ . 1 . 2]" 1
219 1 30 LEU MD2 1 86 TYR HA 2.536 2.079 3.094 2.750 2.440 3.108 0.014 15 0 "[ . 1 . 2]" 1
220 1 30 LEU MD2 1 86 TYR QD 3.280 2.738 3.943 2.821 2.688 3.082 0.050 4 0 "[ . 1 . 2]" 1
221 1 30 LEU MD2 1 86 TYR QE 3.565 2.976 4.285 2.917 2.878 2.959 0.098 15 0 "[ . 1 . 2]" 1
222 1 30 LEU MD2 1 90 GLN H 3.833 3.501 4.467 4.076 3.827 4.350 . 0 0 "[ . 1 . 2]" 1
223 1 30 LEU HG 1 86 TYR QD 4.596 3.836 5.525 4.630 3.816 5.054 0.020 3 0 "[ . 1 . 2]" 1
224 1 30 LEU HG 1 86 TYR QE 4.062 3.391 4.883 4.303 3.309 4.746 0.082 17 0 "[ . 1 . 2]" 1
225 1 30 LEU HG 1 97 ILE MG 4.449 3.646 1003.449 3.495 3.443 3.568 0.203 8 0 "[ . 1 . 2]" 1
226 1 31 SER H 1 31 SER HA 2.666 2.288 3.107 2.854 2.787 2.886 . 0 0 "[ . 1 . 2]" 1
227 1 31 SER H 1 31 SER QB 2.776 2.382 3.235 2.234 2.064 2.633 0.318 3 0 "[ . 1 . 2]" 1
228 1 31 SER H 1 32 VAL H 2.898 2.895 3.377 2.803 2.754 2.927 0.141 13 0 "[ . 1 . 2]" 1
229 1 31 SER H 1 32 VAL QG 3.522 3.023 4.104 3.738 3.451 4.117 0.013 3 0 "[ . 1 . 2]" 1
230 1 31 SER H 1 33 LEU H 4.881 4.189 5.519 4.438 4.163 4.581 0.026 19 0 "[ . 1 . 2]" 1
231 1 31 SER H 1 96 THR HA 4.051 3.477 4.721 4.933 4.906 4.957 0.236 2 0 "[ . 1 . 2]" 1
232 1 31 SER H 1 96 THR MG 4.767 3.907 5.816 4.962 4.866 5.085 . 0 0 "[ . 1 . 2]" 1
233 1 31 SER HA 1 32 VAL H 3.689 3.166 4.299 3.513 3.451 3.569 . 0 0 "[ . 1 . 2]" 1
234 1 31 SER HA 1 33 LEU H 4.293 3.684 4.362 3.903 3.682 4.416 0.054 14 0 "[ . 1 . 2]" 1
235 1 31 SER QB 1 32 VAL H 4.579 3.930 5.336 3.345 3.182 3.762 0.748 12 15 "[***** ***+* .***-*]" 1
236 1 32 VAL H 1 32 VAL HA 2.948 2.604 3.282 2.989 2.927 3.002 . 0 0 "[ . 1 . 2]" 1
237 1 32 VAL H 1 32 VAL HB 3.111 2.670 3.625 3.321 2.584 3.795 0.170 6 0 "[ . 1 . 2]" 1
238 1 32 VAL H 1 32 VAL QG . 2.433 2.717 2.057 1.953 2.218 0.480 15 0 "[ . 1 . 2]" 1
239 1 32 VAL H 1 33 LEU H 2.493 2.145 2.905 2.619 2.151 2.833 . 0 0 "[ . 1 . 2]" 1
240 1 32 VAL HA 1 32 VAL QG 3.102 2.542 3.297 2.301 2.179 2.397 0.363 16 0 "[ . 1 . 2]" 1
241 1 32 VAL HA 1 33 LEU H 3.229 2.771 3.763 3.110 3.012 3.456 . 0 0 "[ . 1 . 2]" 1
242 1 32 VAL HA 1 77 PHE QD 3.703 3.091 4.451 3.742 3.454 3.870 . 0 0 "[ . 1 . 2]" 1
243 1 32 VAL HB 1 33 LEU H 4.189 3.595 4.881 4.489 4.179 4.555 . 0 0 "[ . 1 . 2]" 1
244 1 32 VAL HB 1 77 PHE QD 3.962 3.307 4.763 3.895 3.237 4.893 0.130 20 0 "[ . 1 . 2]" 1
245 1 32 VAL QG 1 33 LEU H 3.497 2.866 3.816 3.221 2.525 3.339 0.341 19 0 "[ . 1 . 2]" 1
246 1 32 VAL QG 1 33 LEU H 2.743 2.354 3.196 2.915 2.448 3.012 . 0 0 "[ . 1 . 2]" 1
247 1 32 VAL QG 1 77 PHE QD 2.756 2.300 3.313 2.238 2.105 2.409 0.195 18 0 "[ . 1 . 2]" 1
248 1 32 VAL QG 1 77 PHE QE 3.405 2.842 4.093 2.867 2.707 3.062 0.135 3 0 "[ . 1 . 2]" 1
249 1 32 VAL QG 1 77 PHE HZ 3.906 3.260 4.695 3.886 3.788 3.951 . 0 0 "[ . 1 . 2]" 1
250 1 32 VAL QG 1 76 TYR QD 3.960 3.305 4.760 3.300 3.257 3.441 0.048 7 0 "[ . 1 . 2]" 1
251 1 32 VAL QG 1 76 TYR QE 3.291 2.747 3.956 2.966 2.882 3.082 . 0 0 "[ . 1 . 2]" 1
252 1 33 LEU H 1 33 LEU HA 3.121 2.678 3.561 2.956 2.831 2.975 . 0 0 "[ . 1 . 2]" 1
253 1 33 LEU H 1 33 LEU HB2 3.078 2.641 3.587 2.876 2.346 3.687 0.295 19 0 "[ . 1 . 2]" 1
254 1 33 LEU H 1 33 LEU HB3 2.780 2.386 3.240 3.146 2.297 3.641 0.401 13 0 "[ . 1 . 2]" 1
255 1 33 LEU H 1 33 LEU QD 3.074 2.979 3.751 3.362 3.149 3.528 . 0 0 "[ . 1 . 2]" 1
256 1 33 LEU H 1 33 LEU HG 2.560 2.197 2.983 2.769 2.321 3.213 0.230 10 0 "[ . 1 . 2]" 1
257 1 33 LEU H 1 34 ILE H . 3.747 4.363 4.513 4.439 4.578 0.215 14 0 "[ . 1 . 2]" 1
258 1 33 LEU H 1 78 TYR QD 3.401 2.839 4.088 4.297 4.220 4.371 0.283 17 0 "[ . 1 . 2]" 1
259 1 33 LEU HA 1 33 LEU QD . 2.780 3.137 2.510 2.107 3.197 0.673 15 12 "[** *** 1*** +* -*]" 1
260 1 33 LEU HA 1 34 ILE H 2.051 . 2.390 2.188 2.145 2.254 . 0 0 "[ . 1 . 2]" 1
261 1 33 LEU HA 1 77 PHE H 4.032 3.703 4.698 4.731 4.286 4.826 0.128 12 0 "[ . 1 . 2]" 1
262 1 33 LEU HB2 1 34 ILE H 3.606 3.095 4.202 3.944 3.154 4.395 0.193 19 0 "[ . 1 . 2]" 1
263 1 33 LEU HB2 1 86 TYR QD 4.335 3.618 5.211 4.538 4.135 5.055 . 0 0 "[ . 1 . 2]" 1
264 1 33 LEU HB2 1 86 TYR QE 3.651 3.047 4.389 4.100 2.845 5.186 0.797 9 6 "[ *. *+* *. - 2]" 1
265 1 33 LEU HB3 1 34 ILE H 3.649 3.132 4.252 3.513 3.149 3.961 . 0 0 "[ . 1 . 2]" 1
266 1 33 LEU QD 1 34 ILE H 3.390 2.778 4.136 3.077 2.688 3.417 0.090 10 0 "[ . 1 . 2]" 1
267 1 33 LEU QD 1 34 ILE H 2.605 2.236 3.036 2.830 2.588 3.010 . 0 0 "[ . 1 . 2]" 1
268 1 33 LEU QD 1 76 TYR QE 2.912 2.387 3.553 2.670 2.301 3.027 0.086 3 0 "[ . 1 . 2]" 1
269 1 33 LEU QD 1 86 TYR QD 2.970 2.479 3.570 2.710 2.414 3.298 0.065 8 0 "[ . 1 . 2]" 1
270 1 33 LEU QD 1 86 TYR QE 2.840 2.370 3.414 2.675 2.303 3.041 0.067 3 0 "[ . 1 . 2]" 1
271 1 34 ILE H 1 34 ILE HA 2.987 2.563 3.481 2.979 2.939 3.007 . 0 0 "[ . 1 . 2]" 1
272 1 34 ILE H 1 34 ILE HB 2.435 2.090 2.837 2.535 2.495 2.602 . 0 0 "[ . 1 . 2]" 1
273 1 34 ILE H 1 34 ILE MD 3.074 2.519 3.751 3.721 3.647 3.796 0.045 18 0 "[ . 1 . 2]" 1
274 1 34 ILE H 1 34 ILE HG13 2.670 2.291 3.111 2.235 2.086 2.432 0.205 5 0 "[ . 1 . 2]" 1
275 1 34 ILE H 1 35 ARG H 4.820 4.137 5.617 4.503 4.343 4.580 . 0 0 "[ . 1 . 2]" 1
276 1 34 ILE H 1 35 ARG H 3.278 2.813 3.820 3.728 3.557 3.867 0.047 14 0 "[ . 1 . 2]" 1
277 1 34 ILE H 1 78 TYR HA 2.750 2.475 3.355 3.376 3.199 3.418 0.063 3 0 "[ . 1 . 2]" 1
278 1 34 ILE H 1 79 SER H 3.643 3.126 4.245 3.983 3.742 4.181 . 0 0 "[ . 1 . 2]" 1
279 1 34 ILE HA 1 34 ILE MD 3.401 2.788 4.149 3.814 3.747 3.859 . 0 0 "[ . 1 . 2]" 1
280 1 34 ILE HA 1 34 ILE HG13 2.779 2.278 3.391 3.211 3.119 3.311 . 0 0 "[ . 1 . 2]" 1
281 1 34 ILE HA 1 34 ILE MG 2.328 2.046 2.840 2.344 2.326 2.369 . 0 0 "[ . 1 . 2]" 1
282 1 34 ILE HA 1 35 ARG H 1.973 . 2.299 2.203 2.175 2.224 . 0 0 "[ . 1 . 2]" 1
283 1 34 ILE HB 1 76 TYR QD 2.836 2.367 3.409 2.435 2.388 2.516 . 0 0 "[ . 1 . 2]" 1
284 1 34 ILE HB 1 35 ARG H 3.274 2.810 3.815 3.832 3.742 3.946 0.131 3 0 "[ . 1 . 2]" 1
285 1 34 ILE HB 1 78 TYR QD 3.038 2.536 3.652 3.178 2.965 3.326 . 0 0 "[ . 1 . 2]" 1
286 1 34 ILE HB 1 78 TYR QE 2.932 2.447 3.525 3.534 3.441 3.669 0.144 14 0 "[ . 1 . 2]" 1
287 1 34 ILE HB 1 78 TYR H 3.771 3.236 4.394 4.687 4.574 4.862 0.468 10 0 "[ . 1 . 2]" 1
288 1 34 ILE HB 1 78 TYR HA 2.544 2.085 3.104 2.287 2.253 2.327 . 0 0 "[ . 1 . 2]" 1
289 1 34 ILE MD 1 78 TYR QE 2.678 2.235 3.219 2.458 2.315 2.879 . 0 0 "[ . 1 . 2]" 1
290 1 34 ILE MD 1 76 TYR HA 3.304 2.708 4.031 2.997 2.665 3.459 0.043 6 0 "[ . 1 . 2]" 1
291 1 34 ILE MD 1 76 TYR QD 3.108 2.547 3.792 2.447 2.403 2.526 0.144 1 0 "[ . 1 . 2]" 1
292 1 34 ILE MD 1 76 TYR QE 3.310 2.713 4.038 2.898 2.708 3.239 0.005 13 0 "[ . 1 . 2]" 1
293 1 34 ILE MD 1 77 PHE H 3.015 2.637 3.513 2.787 2.593 3.342 0.044 12 0 "[ . 1 . 2]" 1
294 1 34 ILE MG 1 35 ARG H 2.659 2.461 3.099 2.585 2.402 2.882 0.059 14 0 "[ . 1 . 2]" 1
295 1 34 ILE MG 1 36 PRO HD2 3.605 2.955 4.398 3.895 3.875 3.924 . 0 0 "[ . 1 . 2]" 1
296 1 34 ILE MG 1 36 PRO HD3 2.879 2.360 3.513 2.302 2.292 2.319 0.068 5 0 "[ . 1 . 2]" 1
297 1 34 ILE MG 1 36 PRO QG 2.857 2.342 3.486 3.070 2.837 3.269 . 0 0 "[ . 1 . 2]" 1
298 1 34 ILE MG 1 76 TYR QE 3.102 2.542 3.784 2.636 2.495 3.125 0.047 1 0 "[ . 1 . 2]" 1
299 1 34 ILE MG 1 78 TYR HA 2.969 2.585 3.622 3.751 3.696 3.851 0.229 14 0 "[ . 1 . 2]" 1
300 1 34 ILE MG 1 78 TYR QD 3.282 2.739 3.945 3.328 3.211 3.599 . 0 0 "[ . 1 . 2]" 1
301 1 35 ARG H 1 35 ARG HA 3.101 2.661 3.614 3.001 2.993 3.011 . 0 0 "[ . 1 . 2]" 1
302 1 35 ARG H 1 35 ARG QB 2.487 2.134 2.898 2.672 2.409 2.789 . 0 0 "[ . 1 . 2]" 1
303 1 35 ARG H 1 35 ARG HG2 3.114 2.672 3.629 3.608 2.752 4.232 0.603 18 2 "[ . 1 - . + 2]" 1
304 1 35 ARG H 1 35 ARG HG3 3.511 3.013 4.091 3.277 2.660 4.221 0.353 2 0 "[ . 1 . 2]" 1
305 1 35 ARG H 1 76 TYR QD 4.064 3.392 4.885 4.972 4.931 5.008 0.123 19 0 "[ . 1 . 2]" 1
306 1 35 ARG H 1 76 TYR QE 3.811 3.181 4.581 3.260 3.192 3.303 . 0 0 "[ . 1 . 2]" 1
307 1 35 ARG HA 1 36 PRO HD2 2.368 . 2.889 2.377 2.332 2.457 . 0 0 "[ . 1 . 2]" 1
308 1 35 ARG HA 1 36 PRO HD3 2.210 . 2.696 2.483 2.398 2.551 . 0 0 "[ . 1 . 2]" 1
309 1 35 ARG HA 1 80 PHE QD 3.580 3.212 4.304 3.946 3.873 4.018 . 0 0 "[ . 1 . 2]" 1
310 1 35 ARG HA 1 78 TYR QD 3.073 2.565 3.694 2.877 2.712 2.966 . 0 0 "[ . 1 . 2]" 1
311 1 35 ARG HA 1 78 TYR QE 3.398 2.836 4.085 4.321 4.266 4.371 0.286 18 0 "[ . 1 . 2]" 1
312 1 35 ARG HD2 1 86 TYR QD 3.889 3.246 4.675 3.910 3.242 4.788 0.113 3 0 "[ . 1 . 2]" 1
313 1 35 ARG HD2 1 86 TYR QE 3.623 3.024 4.355 3.790 2.477 4.580 0.547 18 1 "[ . 1 . + 2]" 1
314 1 35 ARG HD3 1 86 TYR QD 4.353 3.634 5.233 4.036 3.264 4.955 0.370 8 0 "[ . 1 . 2]" 1
315 1 36 PRO HA 1 37 LEU H 3.599 3.089 4.194 3.115 3.065 3.154 0.024 7 0 "[ . 1 . 2]" 1
316 1 36 PRO HB3 1 37 LEU H 5.402 4.636 6.295 4.613 4.600 4.632 0.036 8 0 "[ . 1 . 2]" 1
317 1 36 PRO HB3 1 78 TYR QE 3.310 2.763 3.979 3.598 3.344 3.708 . 0 0 "[ . 1 . 2]" 1
318 1 36 PRO HD2 1 37 LEU H 3.510 3.012 4.090 2.955 2.914 2.996 0.098 10 0 "[ . 1 . 2]" 1
319 1 36 PRO HD2 1 78 TYR QD 3.715 3.101 4.466 3.533 3.365 3.682 . 0 0 "[ . 1 . 2]" 1
320 1 36 PRO HD2 1 78 TYR QE 4.165 3.476 5.007 4.724 4.574 4.876 . 0 0 "[ . 1 . 2]" 1
321 1 36 PRO HD2 1 80 PHE H 3.076 2.640 3.584 3.555 3.530 3.588 0.004 19 0 "[ . 1 . 2]" 1
322 1 36 PRO HD2 1 80 PHE QE 3.549 2.962 4.266 2.901 2.810 2.998 0.152 6 0 "[ . 1 . 2]" 1
323 1 36 PRO HD2 1 80 PHE HZ 4.434 3.701 5.330 4.892 4.798 4.961 . 0 0 "[ . 1 . 2]" 1
324 1 36 PRO HD3 1 37 LEU H 3.967 3.405 4.623 4.058 4.033 4.092 . 0 0 "[ . 1 . 2]" 1
325 1 36 PRO HD3 1 78 TYR QD 3.254 2.716 3.912 3.019 2.700 3.192 0.016 8 0 "[ . 1 . 2]" 1
326 1 36 PRO HD3 1 78 TYR QE 3.250 2.713 3.907 3.709 3.471 3.935 0.028 14 0 "[ . 1 . 2]" 1
327 1 36 PRO HD3 1 80 PHE QD 4.653 3.884 5.593 4.648 4.437 4.842 . 0 0 "[ . 1 . 2]" 1
328 1 36 PRO HD3 1 80 PHE QE 4.337 3.620 5.213 3.680 3.578 3.851 0.042 10 0 "[ . 1 . 2]" 1
329 1 36 PRO HD3 1 80 PHE HZ 4.661 3.891 5.603 5.530 5.392 5.644 0.041 10 0 "[ . 1 . 2]" 1
330 1 36 PRO QG 1 37 LEU H 3.511 3.013 4.091 3.726 3.652 3.855 . 0 0 "[ . 1 . 2]" 1
331 1 36 PRO QG 1 78 TYR QD 2.969 2.478 3.569 2.616 2.416 2.884 0.062 8 0 "[ . 1 . 2]" 1
332 1 36 PRO QG 1 78 TYR QR 2.503 2.051 3.054 2.155 2.101 2.209 . 0 0 "[ . 1 . 2]" 1
333 1 36 PRO QG 1 78 TYR QE 2.642 2.205 3.176 2.300 2.281 2.314 . 0 0 "[ . 1 . 2]" 1
334 1 36 PRO QG 1 80 PHE QE 3.100 2.587 3.727 2.461 2.373 2.538 0.214 8 0 "[ . 1 . 2]" 1
335 1 36 PRO QG 1 80 PHE HZ 3.339 2.787 4.014 4.124 4.052 4.152 0.138 20 0 "[ . 1 . 2]" 1
336 1 36 PRO QG 1 113 LEU MD2 2.843 2.330 3.469 2.929 2.539 3.326 . 0 0 "[ . 1 . 2]" 1
337 1 37 LEU H 1 37 LEU HA 3.122 2.679 3.476 2.986 2.969 3.004 . 0 0 "[ . 1 . 2]" 1
338 1 37 LEU H 1 37 LEU HB2 3.257 2.795 3.795 2.725 2.537 2.929 0.258 18 0 "[ . 1 . 2]" 1
339 1 37 LEU H 1 37 LEU HB3 3.052 2.619 3.556 3.266 2.918 3.635 0.079 11 0 "[ . 1 . 2]" 1
340 1 37 LEU H 1 37 LEU QD 4.355 3.737 4.701 3.711 3.332 3.975 0.405 6 0 "[ . 1 . 2]" 1
341 1 37 LEU H 1 38 PRO HD2 4.828 4.143 5.626 4.625 4.385 4.848 . 0 0 "[ . 1 . 2]" 1
342 1 37 LEU H 1 80 PHE QD 4.165 3.476 5.007 3.792 3.530 3.932 . 0 0 "[ . 1 . 2]" 1
343 1 37 LEU H 1 80 PHE QD 5.076 4.358 5.915 4.879 4.697 5.110 . 0 0 "[ . 1 . 2]" 1
344 1 37 LEU H 1 80 PHE QE 4.666 4.004 5.437 5.413 5.300 5.512 0.075 11 0 "[ . 1 . 2]" 1
345 1 37 LEU HA 1 38 PRO HD2 2.697 2.210 3.034 2.308 2.262 2.440 . 0 0 "[ . 1 . 2]" 1
346 1 37 LEU HA 1 38 PRO HD3 2.566 2.103 2.949 2.461 2.318 2.584 . 0 0 "[ . 1 . 2]" 1
347 1 37 LEU HB2 1 80 PHE QD 3.360 2.805 4.039 3.069 2.938 3.213 . 0 0 "[ . 1 . 2]" 1
348 1 37 LEU HB2 1 80 PHE QE 3.217 2.685 3.867 3.586 3.362 3.855 . 0 0 "[ . 1 . 2]" 1
349 1 37 LEU HB2 1 80 PHE HZ 3.334 2.783 4.008 3.498 3.121 3.813 . 0 0 "[ . 1 . 2]" 1
350 1 37 LEU HB3 1 80 PHE QD 3.678 3.070 4.421 4.022 3.556 4.373 . 0 0 "[ . 1 . 2]" 1
351 1 37 LEU QD 1 38 PRO HD2 3.869 3.171 4.721 3.278 2.973 3.690 0.198 9 0 "[ . 1 . 2]" 1
352 1 37 LEU QD 1 38 PRO HD3 3.736 3.062 4.558 4.003 3.772 4.187 . 0 0 "[ . 1 . 2]" 1
353 1 37 LEU QD 1 80 PHE HA . 3.159 3.406 3.404 3.316 3.463 0.057 15 0 "[ . 1 . 2]" 1
354 1 37 LEU QD 1 80 PHE QD 3.454 3.278 3.680 2.802 2.625 3.046 0.653 6 10 "[-* .+ * 1* * * ***]" 1
355 1 37 LEU QD 1 80 PHE QE 3.368 2.811 4.049 3.692 3.121 4.062 0.013 4 0 "[ . 1 . 2]" 1
356 1 37 LEU QD 1 112 TYR QD 4.033 3.366 4.848 4.679 4.430 4.789 . 0 0 "[ . 1 . 2]" 1
357 1 37 LEU QD 1 113 LEU MD2 2.699 2.212 3.293 2.887 1.976 3.360 0.236 18 0 "[ . 1 . 2]" 1
358 1 38 PRO HA 1 39 SER H 2.151 . 2.506 2.393 2.341 2.435 . 0 0 "[ . 1 . 2]" 1
359 1 38 PRO HB2 1 39 SER H 3.182 2.731 3.708 2.961 2.722 3.506 0.009 11 0 "[ . 1 . 2]" 1
360 1 38 PRO HB3 1 39 SER H 3.259 2.797 3.798 3.494 2.960 3.744 . 0 0 "[ . 1 . 2]" 1
361 1 39 SER H 1 39 SER HA 2.882 2.764 3.358 2.939 2.934 2.952 . 0 0 "[ . 1 . 2]" 1
362 1 39 SER H 1 39 SER QB 3.041 2.610 3.544 3.012 2.809 3.232 . 0 0 "[ . 1 . 2]" 1
363 1 39 SER H 1 40 VAL H 4.854 4.166 5.656 4.249 4.136 4.401 0.030 15 0 "[ . 1 . 2]" 1
364 1 39 SER HA 1 40 VAL H 2.268 . 2.643 2.261 2.193 2.415 . 0 0 "[ . 1 . 2]" 1
365 1 39 SER QB 1 40 VAL H 2.784 2.389 3.244 3.069 2.602 3.278 0.034 2 0 "[ . 1 . 2]" 1
366 1 39 SER QB 1 41 LEU MD2 3.465 2.840 4.228 3.173 2.825 3.739 0.015 6 0 "[ . 1 . 2]" 1
367 1 39 SER QB 1 84 HIS HE1 4.511 3.765 5.423 3.951 3.735 4.477 0.030 19 0 "[ . 1 . 2]" 1
368 1 40 VAL H 1 40 VAL HA . 2.639 2.800 2.874 2.790 2.951 0.151 18 0 "[ . 1 . 2]" 1
369 1 40 VAL H 1 40 VAL HA 2.120 . 2.587 2.132 2.107 2.172 . 0 0 "[ . 1 . 2]" 1
370 1 40 VAL H 1 40 VAL HB 2.457 2.109 2.863 2.387 2.329 2.421 . 0 0 "[ . 1 . 2]" 1
371 1 40 VAL H 1 40 VAL MG1 3.029 2.483 3.696 3.160 2.396 3.768 0.087 1 0 "[ . 1 . 2]" 1
372 1 40 VAL H 1 40 VAL QG 2.501 2.146 2.914 2.407 2.370 2.458 . 0 0 "[ . 1 . 2]" 1
373 1 40 VAL H 1 40 VAL MG2 3.011 2.468 3.674 2.562 2.291 2.853 0.177 11 0 "[ . 1 . 2]" 1
374 1 40 VAL HA 1 41 LEU H 1.996 . 2.326 2.199 2.178 2.263 . 0 0 "[ . 1 . 2]" 1
375 1 40 VAL HB 1 41 LEU H 3.995 3.429 4.655 4.423 4.197 4.470 . 0 0 "[ . 1 . 2]" 1
376 1 40 VAL MG1 1 84 HIS HD2 3.987 3.328 4.793 4.491 4.331 5.241 0.448 17 0 "[ . 1 . 2]" 1
377 1 40 VAL MG2 1 41 LEU H 2.556 2.194 2.978 3.108 2.293 3.438 0.460 18 0 "[ . 1 . 2]" 1
378 1 40 VAL MG2 1 84 HIS HE1 3.782 3.157 4.546 4.671 4.533 4.772 0.226 7 0 "[ . 1 . 2]" 1
379 1 41 LEU H 1 41 LEU HA 3.130 2.686 3.647 2.951 2.919 2.995 . 0 0 "[ . 1 . 2]" 1
380 1 41 LEU H 1 41 LEU HB2 2.682 2.302 3.125 2.563 2.549 2.627 . 0 0 "[ . 1 . 2]" 1
381 1 41 LEU H 1 41 LEU MD1 3.622 3.108 3.841 3.661 3.602 3.858 0.017 11 0 "[ . 1 . 2]" 1
382 1 41 LEU H 1 41 LEU MD2 3.536 3.035 4.121 3.393 3.325 3.561 . 0 0 "[ . 1 . 2]" 1
383 1 41 LEU H 1 41 LEU HG 2.654 2.278 3.093 2.309 2.229 2.594 0.049 13 0 "[ . 1 . 2]" 1
384 1 41 LEU H 1 42 ASP H 4.231 3.631 4.930 4.583 4.494 4.612 . 0 0 "[ . 1 . 2]" 1
385 1 41 LEU H 1 84 HIS HE1 4.403 3.921 5.131 5.231 5.195 5.278 0.147 3 0 "[ . 1 . 2]" 1
386 1 41 LEU HA 1 41 LEU MD1 3.818 3.129 4.658 3.832 3.823 3.847 . 0 0 "[ . 1 . 2]" 1
387 1 41 LEU HA 1 41 LEU MD2 2.502 2.213 3.053 2.149 2.135 2.172 0.078 16 0 "[ . 1 . 2]" 1
388 1 41 LEU HA 1 42 ASP H 2.020 . 2.354 2.243 2.227 2.257 . 0 0 "[ . 1 . 2]" 1
389 1 41 LEU HA 1 84 HIS HD2 3.858 3.175 4.638 3.978 3.926 4.045 . 0 0 "[ . 1 . 2]" 1
390 1 41 LEU HA 1 84 HIS HE1 3.427 2.861 3.914 2.896 2.843 2.941 0.018 19 0 "[ . 1 . 2]" 1
391 1 41 LEU HB2 1 41 LEU MD1 2.251 . 2.746 2.082 2.015 2.162 . 0 0 "[ . 1 . 2]" 1
392 1 41 LEU HB2 1 41 LEU MD2 2.529 2.073 3.086 2.717 2.620 2.768 . 0 0 "[ . 1 . 2]" 1
393 1 41 LEU HB2 1 42 ASP H 3.082 2.645 3.591 3.779 3.762 3.790 0.199 5 0 "[ . 1 . 2]" 1
394 1 41 LEU HB2 1 84 HIS HD2 3.354 2.800 4.032 2.738 2.707 2.764 0.093 12 0 "[ . 1 . 2]" 1
395 1 41 LEU HB2 1 84 HIS HE1 3.471 2.897 4.172 3.968 3.884 4.029 . 0 0 "[ . 1 . 2]" 1
396 1 41 LEU HB3 1 42 ASP H 2.785 2.391 3.245 2.774 2.760 2.790 . 0 0 "[ . 1 . 2]" 1
397 1 41 LEU MD1 1 46 VAL MG2 2.688 2.203 3.272 3.294 3.271 3.305 0.033 18 0 "[ . 1 . 2]" 1
398 1 41 LEU MD1 1 84 HIS HA 3.430 2.811 4.185 3.762 3.664 3.884 . 0 0 "[ . 1 . 2]" 1
399 1 41 LEU MD1 1 84 HIS HD2 4.434 3.701 5.330 5.340 5.303 5.374 0.044 11 0 "[ . 1 . 2]" 1
400 1 41 LEU MD1 1 87 ALA H 4.277 3.670 4.984 4.205 4.018 4.426 . 0 0 "[ . 1 . 2]" 1
401 1 41 LEU MD1 1 87 ALA MB 2.684 2.200 3.275 2.317 2.193 2.499 0.007 10 0 "[ . 1 . 2]" 1
402 1 41 LEU MD2 1 42 ASP H 2.868 2.461 3.342 3.462 3.423 3.501 0.159 1 0 "[ . 1 . 2]" 1
403 1 41 LEU MD2 1 46 VAL MG2 2.971 2.435 3.244 3.286 3.246 3.319 0.075 14 0 "[ . 1 . 2]" 1
404 1 41 LEU MD2 1 83 CYS HB2 3.542 2.903 4.322 3.812 2.910 4.323 0.001 11 0 "[ . 1 . 2]" 1
405 1 41 LEU MD2 1 83 CYS HB3 2.962 2.428 3.614 2.916 2.561 3.334 . 0 0 "[ . 1 . 2]" 1
406 1 41 LEU MD2 1 84 HIS H 3.530 3.029 4.113 3.645 3.479 3.792 . 0 0 "[ . 1 . 2]" 1
407 1 41 LEU MD2 1 84 HIS HA 3.041 2.492 3.474 2.465 2.433 2.525 0.059 9 0 "[ . 1 . 2]" 1
408 1 41 LEU MD2 1 84 HIS HD2 3.410 2.846 4.099 3.707 3.644 3.779 . 0 0 "[ . 1 . 2]" 1
409 1 41 LEU MD2 1 84 HIS HE1 3.522 2.940 4.234 2.839 2.799 2.884 0.141 3 0 "[ . 1 . 2]" 1
410 1 41 LEU MD2 1 86 TYR QD 4.913 4.101 5.906 4.691 4.239 5.322 . 0 0 "[ . 1 . 2]" 1
411 1 41 LEU MD2 1 87 ALA H 4.401 3.777 5.128 4.231 4.124 4.312 . 0 0 "[ . 1 . 2]" 1
412 1 41 LEU MD2 1 87 ALA MB 3.408 2.793 4.158 3.183 2.927 3.339 . 0 0 "[ . 1 . 2]" 1
413 1 42 ASP H 1 42 ASP HA 2.914 2.501 3.343 2.990 2.989 2.992 . 0 0 "[ . 1 . 2]" 1
414 1 42 ASP H 1 42 ASP HB2 2.462 2.113 2.888 3.054 3.023 3.078 0.190 11 0 "[ . 1 . 2]" 1
415 1 42 ASP H 1 42 ASP HB3 2.400 2.060 2.797 2.462 2.440 2.489 . 0 0 "[ . 1 . 2]" 1
416 1 42 ASP HA 1 43 PRO HD2 2.063 . 2.517 2.402 2.358 2.439 . 0 0 "[ . 1 . 2]" 1
417 1 42 ASP HA 1 43 PRO HD3 2.093 . 2.554 2.326 2.317 2.334 . 0 0 "[ . 1 . 2]" 1
418 1 42 ASP HA 1 44 ALA H 4.028 3.457 4.141 4.031 3.961 4.110 . 0 0 "[ . 1 . 2]" 1
419 1 42 ASP HA 1 45 LYS H 4.720 4.051 5.500 4.863 4.771 4.929 . 0 0 "[ . 1 . 2]" 1
420 1 42 ASP HB2 1 45 LYS H 4.147 3.559 4.833 4.399 4.343 4.437 . 0 0 "[ . 1 . 2]" 1
421 1 42 ASP HB2 1 49 LEU MD1 3.018 2.474 3.682 2.262 2.207 2.309 0.267 19 0 "[ . 1 . 2]" 1
422 1 42 ASP HB2 1 84 HIS H 2.572 2.207 3.007 2.611 2.309 3.254 0.247 16 0 "[ . 1 . 2]" 1
423 1 42 ASP HB2 1 84 HIS HD2 3.307 2.760 3.975 2.715 2.710 2.722 0.050 20 0 "[ . 1 . 2]" 1
424 1 42 ASP HB2 1 84 HIS HE1 4.195 3.502 5.043 3.787 3.518 4.335 . 0 0 "[ . 1 . 2]" 1
425 1 42 ASP HB3 1 44 ALA H 4.789 4.110 5.581 4.004 3.963 4.044 0.147 7 0 "[ . 1 . 2]" 1
426 1 42 ASP HB3 1 45 LYS H 3.600 3.089 4.195 3.058 3.023 3.088 0.066 4 0 "[ . 1 . 2]" 1
427 1 42 ASP HB3 1 84 HIS HD2 3.986 3.327 4.792 3.265 3.246 3.282 0.081 3 0 "[ . 1 . 2]" 1
428 1 42 ASP HB3 1 84 HIS HE1 4.684 3.910 5.631 5.247 5.154 5.333 . 0 0 "[ . 1 . 2]" 1
429 1 43 PRO HA 1 44 ALA H 2.661 2.284 3.101 2.729 2.724 2.734 . 0 0 "[ . 1 . 2]" 1
430 1 43 PRO HA 1 43 PRO HG3 2.701 2.214 3.296 2.812 2.683 2.861 . 0 0 "[ . 1 . 2]" 1
431 1 43 PRO HA 1 44 ALA H 4.105 3.365 5.008 3.502 3.484 3.521 . 0 0 "[ . 1 . 2]" 1
432 1 43 PRO HA 1 45 LYS H 3.154 2.707 3.675 3.454 3.423 3.480 . 0 0 "[ . 1 . 2]" 1
433 1 43 PRO HA 1 46 VAL H 3.118 2.676 3.633 3.571 3.412 3.642 0.009 17 0 "[ . 1 . 2]" 1
434 1 43 PRO HA 1 47 GLN H 3.231 2.773 3.765 3.520 3.411 3.573 . 0 0 "[ . 1 . 2]" 1
435 1 43 PRO HA 1 45 LYS H 3.932 3.223 4.797 4.642 4.510 4.767 . 0 0 "[ . 1 . 2]" 1
436 1 43 PRO HA 1 46 VAL H 2.990 2.451 3.648 3.496 3.295 3.562 . 0 0 "[ . 1 . 2]" 1
437 1 43 PRO HA 1 46 VAL MG1 3.446 2.824 4.179 4.159 3.980 4.213 0.034 12 0 "[ . 1 . 2]" 1
438 1 43 PRO HA 1 46 VAL MG2 2.780 2.415 3.392 3.336 3.260 3.402 0.010 1 0 "[ . 1 . 2]" 1
439 1 43 PRO HB2 1 44 ALA H 3.242 2.782 3.778 2.644 2.586 2.703 0.196 10 0 "[ . 1 . 2]" 1
440 1 43 PRO HB3 1 44 ALA H 4.445 3.815 5.180 4.322 4.290 4.350 . 0 0 "[ . 1 . 2]" 1
441 1 43 PRO HD2 1 44 ALA H 2.986 2.689 3.643 2.645 2.628 2.660 0.061 1 0 "[ . 1 . 2]" 1
442 1 43 PRO HD2 1 44 ALA MB 3.216 2.636 3.924 3.914 3.874 3.947 0.023 20 0 "[ . 1 . 2]" 1
443 1 43 PRO HD3 1 44 ALA H 3.351 2.747 4.089 3.888 3.878 3.901 . 0 0 "[ . 1 . 2]" 1
444 1 43 PRO HG2 1 44 ALA MB 3.979 3.263 4.852 3.465 3.435 3.571 . 0 0 "[ . 1 . 2]" 1
445 1 43 PRO HG3 1 44 ALA H 3.399 2.917 3.961 4.138 4.094 4.185 0.224 9 0 "[ . 1 . 2]" 1
446 1 43 PRO HG3 1 44 ALA MB 4.132 3.386 5.042 4.994 4.972 5.055 0.013 10 0 "[ . 1 . 2]" 1
447 1 44 ALA H 1 44 ALA HA 2.899 2.376 3.537 2.927 2.921 2.931 . 0 0 "[ . 1 . 2]" 1
448 1 44 ALA H 1 44 ALA MB 2.275 2.036 2.651 2.262 2.218 2.282 . 0 0 "[ . 1 . 2]" 1
449 1 44 ALA H 1 45 LYS H 2.532 2.236 2.951 2.490 2.452 2.553 . 0 0 "[ . 1 . 2]" 1
450 1 44 ALA H 1 45 LYS HB2 4.888 4.195 5.696 4.422 4.332 4.489 . 0 0 "[ . 1 . 2]" 1
451 1 44 ALA H 1 45 LYS HB3 5.046 4.331 5.880 5.496 5.429 5.796 . 0 0 "[ . 1 . 2]" 1
452 1 44 ALA H 1 45 LYS HG2 4.576 3.927 5.332 4.741 4.588 4.793 . 0 0 "[ . 1 . 2]" 1
453 1 44 ALA H 1 46 VAL H 3.733 3.355 4.168 3.918 3.834 4.036 . 0 0 "[ . 1 . 2]" 1
454 1 44 ALA HA 1 45 LYS H 3.620 2.967 4.417 3.563 3.546 3.577 . 0 0 "[ . 1 . 2]" 1
455 1 44 ALA HA 1 46 VAL H 2.899 2.376 3.537 3.600 3.561 3.643 0.106 8 0 "[ . 1 . 2]" 1
456 1 44 ALA HA 1 47 GLN QB 2.958 2.424 3.609 3.097 2.895 3.231 . 0 0 "[ . 1 . 2]" 1
457 1 44 ALA MB 1 45 LYS H 2.697 2.483 3.143 2.514 2.473 2.560 0.010 7 0 "[ . 1 . 2]" 1
458 1 45 LYS H 1 45 LYS HA 2.825 2.424 3.292 2.893 2.881 2.900 . 0 0 "[ . 1 . 2]" 1
459 1 45 LYS H 1 45 LYS HB2 2.683 2.303 3.127 2.148 2.129 2.153 0.174 11 0 "[ . 1 . 2]" 1
460 1 45 LYS H 1 45 LYS HB3 2.660 2.283 3.100 3.182 3.151 3.427 0.327 11 0 "[ . 1 . 2]" 1
461 1 45 LYS H 1 45 LYS HD2 4.158 3.568 4.845 4.773 4.270 4.984 0.139 18 0 "[ . 1 . 2]" 1
462 1 45 LYS H 1 45 LYS HG2 3.226 2.769 3.759 3.878 3.282 4.576 0.817 17 1 "[ . 1 . + 2]" 1
463 1 45 LYS H 1 45 LYS HG3 4.428 3.800 5.160 4.383 3.873 4.451 . 0 0 "[ . 1 . 2]" 1
464 1 45 LYS H 1 46 VAL H 2.675 2.296 3.117 2.581 2.530 2.631 . 0 0 "[ . 1 . 2]" 1
465 1 45 LYS H 1 46 VAL H 2.586 2.219 3.013 2.559 2.509 2.603 . 0 0 "[ . 1 . 2]" 1
466 1 45 LYS H 1 46 VAL HB 4.382 3.761 5.106 4.740 4.617 4.795 . 0 0 "[ . 1 . 2]" 1
467 1 45 LYS H 1 47 GLN H 4.625 3.969 5.389 4.230 4.014 4.477 . 0 0 "[ . 1 . 2]" 1
468 1 45 LYS H 1 84 HIS HD2 3.847 3.301 4.483 4.501 4.319 4.533 0.050 15 0 "[ . 1 . 2]" 1
469 1 45 LYS HA 1 45 LYS HG2 2.725 2.233 3.325 2.345 2.315 2.691 . 0 0 "[ . 1 . 2]" 1
470 1 45 LYS HA 1 45 LYS HG3 3.397 2.784 4.145 3.499 2.320 3.576 0.464 17 0 "[ . 1 . 2]" 1
471 1 45 LYS HA 1 46 VAL H 3.533 3.032 4.117 3.555 3.536 3.578 . 0 0 "[ . 1 . 2]" 1
472 1 45 LYS HA 1 46 VAL H 2.908 2.383 3.548 3.003 2.913 3.095 . 0 0 "[ . 1 . 2]" 1
473 1 45 LYS HA 1 47 GLN H 4.565 3.918 5.320 4.357 4.111 4.665 . 0 0 "[ . 1 . 2]" 1
474 1 45 LYS HA 1 48 SER H 3.373 2.895 3.931 3.242 3.085 3.411 . 0 0 "[ . 1 . 2]" 1
475 1 45 LYS HA 1 48 SER QB 2.368 . 2.889 2.607 2.307 2.839 . 0 0 "[ . 1 . 2]" 1
476 1 45 LYS HB2 1 46 VAL H 3.616 3.103 4.214 3.422 3.155 3.534 . 0 0 "[ . 1 . 2]" 1
477 1 45 LYS HB2 1 84 HIS HD2 3.441 2.872 4.136 3.564 2.849 3.635 0.023 11 0 "[ . 1 . 2]" 1
478 1 45 LYS HB3 1 46 VAL H 3.371 2.893 3.928 3.014 2.866 3.436 0.027 3 0 "[ . 1 . 2]" 1
479 1 45 LYS HB3 1 84 HIS HD2 3.113 2.598 3.742 2.498 2.458 2.559 0.140 1 0 "[ . 1 . 2]" 1
480 1 45 LYS HD2 1 84 HIS HD2 3.277 2.735 3.939 3.465 3.345 3.641 . 0 0 "[ . 1 . 2]" 1
481 1 45 LYS HD2 1 84 HIS H 3.475 2.982 4.049 4.274 4.212 4.367 0.318 15 0 "[ . 1 . 2]" 1
482 1 45 LYS HG2 1 46 VAL H 2.349 2.016 2.737 2.243 2.109 2.325 . 0 0 "[ . 1 . 2]" 1
483 1 45 LYS HG2 1 84 HIS HD2 2.596 2.167 3.121 2.279 2.267 2.293 . 0 0 "[ . 1 . 2]" 1
484 1 45 LYS HG3 1 46 VAL H 4.604 3.951 5.365 5.305 5.074 5.423 0.058 12 0 "[ . 1 . 2]" 1
485 1 46 VAL H 1 46 VAL HA 2.924 2.509 3.407 2.854 2.831 2.905 . 0 0 "[ . 1 . 2]" 1
486 1 46 VAL H 1 46 VAL HA 2.713 2.224 3.310 2.744 2.726 2.779 . 0 0 "[ . 1 . 2]" 1
487 1 46 VAL H 1 46 VAL HB 2.610 2.240 3.041 2.461 2.402 2.534 . 0 0 "[ . 1 . 2]" 1
488 1 46 VAL H 1 46 VAL MG1 3.297 2.829 3.842 3.777 3.763 3.788 . 0 0 "[ . 1 . 2]" 1
489 1 46 VAL H 1 46 VAL MG1 2.969 2.433 3.623 3.071 2.875 3.209 . 0 0 "[ . 1 . 2]" 1
490 1 46 VAL H 1 46 VAL MG2 2.350 . 2.867 2.232 2.102 2.312 . 0 0 "[ . 1 . 2]" 1
491 1 46 VAL H 1 47 GLN HA 2.742 2.247 3.346 2.849 2.822 2.874 . 0 0 "[ . 1 . 2]" 1
492 1 46 VAL H 1 47 GLN QB 4.064 3.488 4.736 4.575 4.330 4.687 . 0 0 "[ . 1 . 2]" 1
493 1 46 VAL H 1 47 GLN HG3 4.805 4.124 5.599 5.817 5.517 6.420 0.821 12 6 "[* -*. 1*+ . * 2]" 1
494 1 46 VAL H 1 84 HIS HD2 3.099 2.660 3.611 3.391 3.259 3.602 . 0 0 "[ . 1 . 2]" 1
495 1 46 VAL H 1 84 HIS HD2 3.026 2.526 3.637 3.257 3.156 3.410 . 0 0 "[ . 1 . 2]" 1
496 1 46 VAL HA 1 47 GLN H 3.765 3.231 4.387 3.558 3.538 3.591 . 0 0 "[ . 1 . 2]" 1
497 1 46 VAL HA 1 48 SER H 4.935 4.235 5.751 4.371 4.222 4.572 0.013 1 0 "[ . 1 . 2]" 1
498 1 46 VAL HA 1 49 LEU H 3.389 2.908 3.949 3.480 3.366 3.628 . 0 0 "[ . 1 . 2]" 1
499 1 46 VAL HA 1 49 LEU HB2 3.067 2.514 3.742 2.854 2.681 3.119 . 0 0 "[ . 1 . 2]" 1
500 1 46 VAL HA 1 49 LEU MD1 2.743 2.354 3.196 2.420 2.335 2.513 0.019 3 0 "[ . 1 . 2]" 1
501 1 46 VAL HA 1 50 VAL H 4.242 3.641 4.943 3.961 3.770 4.228 . 0 0 "[ . 1 . 2]" 1
502 1 46 VAL HA 1 84 HIS H 2.624 2.252 3.058 2.354 2.300 2.391 . 0 0 "[ . 1 . 2]" 1
503 1 46 VAL HA 1 84 HIS HD2 3.576 2.985 4.299 3.362 3.313 3.403 . 0 0 "[ . 1 . 2]" 1
504 1 46 VAL HB 1 47 GLN H 2.620 2.249 3.053 2.599 2.448 2.724 . 0 0 "[ . 1 . 2]" 1
505 1 46 VAL HB 1 84 HIS HD2 4.497 3.754 5.406 4.781 4.711 4.833 . 0 0 "[ . 1 . 2]" 1
506 1 46 VAL MG1 1 47 GLN H 3.313 2.843 3.861 3.258 2.983 3.466 . 0 0 "[ . 1 . 2]" 1
507 1 46 VAL MG1 1 47 GLN HE21 4.202 3.606 4.897 4.330 3.585 4.898 0.021 19 0 "[ . 1 . 2]" 1
508 1 46 VAL MG1 1 47 GLN HE22 4.123 3.538 4.805 4.497 3.507 4.914 0.109 19 0 "[ . 1 . 2]" 1
509 1 46 VAL MG1 1 47 GLN HE22 3.458 2.834 4.219 3.566 3.233 3.836 . 0 0 "[ . 1 . 2]" 1
510 1 46 VAL MG1 1 50 VAL H 2.560 2.197 2.983 3.178 3.136 3.278 0.295 19 0 "[ . 1 . 2]" 1
511 1 46 VAL MG1 1 88 ALA H 2.959 2.539 3.448 3.405 3.129 3.500 0.052 10 0 "[ . 1 . 2]" 1
512 1 46 VAL MG1 1 88 ALA MB 2.345 . 2.861 2.697 2.455 2.869 0.008 6 0 "[ . 1 . 2]" 1
513 1 46 VAL MG1 1 91 GLN H 4.343 3.737 5.050 4.888 4.584 5.075 0.025 12 0 "[ . 1 . 2]" 1
514 1 46 VAL MG1 1 91 GLN HE21 4.049 3.475 4.496 4.442 3.983 4.559 0.063 7 0 "[ . 1 . 2]" 1
515 1 46 VAL MG1 1 87 ALA H 4.084 3.505 4.759 4.793 4.671 4.843 0.084 20 0 "[ . 1 . 2]" 1
516 1 46 VAL MG1 1 87 ALA MB 2.693 2.207 3.097 2.480 2.384 2.657 . 0 0 "[ . 1 . 2]" 1
517 1 46 VAL MG1 1 88 ALA H 3.509 2.876 4.281 3.417 3.135 3.515 . 0 0 "[ . 1 . 2]" 1
518 1 46 VAL MG1 1 88 ALA HA 2.530 2.206 3.087 3.010 2.714 3.102 0.015 18 0 "[ . 1 . 2]" 1
519 1 46 VAL MG2 1 47 GLN H 3.565 3.060 4.154 3.922 3.869 3.951 . 0 0 "[ . 1 . 2]" 1
520 1 46 VAL MG2 1 84 HIS HA 2.887 2.366 3.515 3.001 2.898 3.087 . 0 0 "[ . 1 . 2]" 1
521 1 46 VAL MG2 1 84 HIS HB3 3.440 2.819 4.197 2.935 2.803 3.160 0.016 4 0 "[ . 1 . 2]" 1
522 1 46 VAL MG2 1 84 HIS HD2 2.853 2.338 3.481 2.281 2.269 2.295 0.069 1 0 "[ . 1 . 2]" 1
523 1 46 VAL MG2 1 87 ALA H 4.156 3.567 4.843 4.519 4.399 4.667 . 0 0 "[ . 1 . 2]" 1
524 1 46 VAL MG2 1 87 ALA MB 2.512 2.059 2.773 2.448 2.233 2.776 0.003 3 0 "[ . 1 . 2]" 1
525 1 47 GLN H 1 47 GLN HA 2.798 2.402 3.261 2.859 2.832 2.885 . 0 0 "[ . 1 . 2]" 1
526 1 47 GLN H 1 47 GLN QB 2.521 2.164 2.938 2.296 2.210 2.417 . 0 0 "[ . 1 . 2]" 1
527 1 47 GLN H 1 47 GLN HG3 3.407 2.924 3.970 3.373 2.909 3.957 0.015 6 0 "[ . 1 . 2]" 1
528 1 47 GLN H 1 48 SER H 2.862 2.456 3.335 2.683 2.584 2.765 . 0 0 "[ . 1 . 2]" 1
529 1 47 GLN H 1 49 LEU H 2.758 2.367 3.214 2.772 2.632 2.842 . 0 0 "[ . 1 . 2]" 1
530 1 47 GLN H 1 50 VAL H 3.673 3.152 4.280 3.924 3.819 3.991 . 0 0 "[ . 1 . 2]" 1
531 1 47 GLN H 1 48 SER QB 4.347 3.731 5.066 4.515 4.318 4.847 . 0 0 "[ . 1 . 2]" 1
532 1 47 GLN H 1 50 VAL H 5.157 4.426 6.009 4.697 4.596 4.826 . 0 0 "[ . 1 . 2]" 1
533 1 47 GLN HA 1 47 GLN HE21 4.606 3.953 5.367 4.440 4.269 4.695 . 0 0 "[ . 1 . 2]" 1
534 1 47 GLN HA 1 47 GLN HE21 3.673 3.010 4.482 3.724 3.623 3.828 . 0 0 "[ . 1 . 2]" 1
535 1 47 GLN HA 1 47 GLN HE22 5.144 4.415 5.994 4.885 4.398 5.577 0.017 14 0 "[ . 1 . 2]" 1
536 1 47 GLN HA 1 48 SER H 3.498 3.002 4.076 3.552 3.536 3.576 . 0 0 "[ . 1 . 2]" 1
537 1 47 GLN HA 1 49 LEU H 3.938 3.380 4.589 4.519 4.480 4.572 . 0 0 "[ . 1 . 2]" 1
538 1 47 GLN HA 1 50 VAL H 2.906 2.494 3.386 3.403 3.328 3.446 0.060 1 0 "[ . 1 . 2]" 1
539 1 47 GLN HA 1 50 VAL HB 2.484 2.036 3.031 2.319 2.304 2.335 . 0 0 "[ . 1 . 2]" 1
540 1 47 GLN HA 1 50 VAL MG1 2.902 2.379 3.541 3.626 3.567 3.655 0.114 19 0 "[ . 1 . 2]" 1
541 1 47 GLN HA 1 50 VAL MG2 2.842 2.329 3.468 3.218 2.956 3.418 . 0 0 "[ . 1 . 2]" 1
542 1 47 GLN HA 1 50 VAL MG2 2.328 . 2.840 2.041 1.985 2.134 . 0 0 "[ . 1 . 2]" 1
543 1 47 GLN HA 1 51 ASP H 3.986 3.421 4.645 4.011 3.834 4.170 . 0 0 "[ . 1 . 2]" 1
544 1 47 GLN HB2 1 48 SER H 2.934 2.518 3.419 2.695 2.436 2.835 0.082 5 0 "[ . 1 . 2]" 1
545 1 47 GLN HE22 1 50 VAL MG2 3.487 2.858 4.254 4.146 4.040 4.396 0.142 18 0 "[ . 1 . 2]" 1
546 1 47 GLN HG2 1 48 SER H 4.533 3.890 5.282 4.880 4.300 5.321 0.039 10 0 "[ . 1 . 2]" 1
547 1 48 SER H 1 48 SER HA 2.833 2.431 3.301 2.841 2.814 2.878 . 0 0 "[ . 1 . 2]" 1
548 1 48 SER H 1 48 SER QB 2.399 2.059 2.796 2.302 2.202 2.660 . 0 0 "[ . 1 . 2]" 1
549 1 48 SER H 1 49 LEU H 3.002 2.576 3.498 2.806 2.657 2.884 . 0 0 "[ . 1 . 2]" 1
550 1 48 SER H 1 49 LEU HG 4.713 4.045 5.492 4.981 4.554 5.153 . 0 0 "[ . 1 . 2]" 1
551 1 48 SER H 1 50 VAL H 4.460 3.828 5.197 4.207 4.070 4.341 . 0 0 "[ . 1 . 2]" 1
552 1 48 SER HA 1 49 LEU H 3.449 2.999 4.019 3.581 3.569 3.588 . 0 0 "[ . 1 . 2]" 1
553 1 48 SER HA 1 50 VAL H 3.945 3.386 4.597 4.410 4.342 4.483 . 0 0 "[ . 1 . 2]" 1
554 1 48 SER HA 1 51 ASP H 3.618 2.965 4.414 3.564 3.506 3.631 . 0 0 "[ . 1 . 2]" 1
555 1 48 SER HA 1 51 ASP H 2.634 2.260 3.069 2.778 2.765 2.799 . 0 0 "[ . 1 . 2]" 1
556 1 48 SER HA 1 52 THR H 2.998 2.573 3.494 3.411 3.338 3.470 . 0 0 "[ . 1 . 2]" 1
557 1 48 SER HA 1 51 ASP HB2 3.627 2.973 4.425 2.879 2.524 3.210 0.449 5 0 "[ . 1 . 2]" 1
558 1 48 SER HA 1 51 ASP HB3 3.094 2.536 3.775 3.575 2.800 4.437 0.662 10 1 "[ . + . 2]" 1
559 1 48 SER QB 1 49 LEU H 2.574 2.209 3.000 2.363 2.268 2.693 . 0 0 "[ . 1 . 2]" 1
560 1 49 LEU H 1 49 LEU HA 2.544 2.183 2.964 2.641 2.599 2.675 . 0 0 "[ . 1 . 2]" 1
561 1 49 LEU H 1 49 LEU HB2 2.525 2.167 2.942 2.289 2.251 2.436 . 0 0 "[ . 1 . 2]" 1
562 1 49 LEU H 1 49 LEU HB3 2.847 2.443 3.318 3.547 3.537 3.586 0.268 3 0 "[ . 1 . 2]" 1
563 1 49 LEU H 1 49 LEU MD1 3.120 2.557 3.807 3.321 3.113 3.492 . 0 0 "[ . 1 . 2]" 1
564 1 49 LEU H 1 49 LEU QD 2.938 2.521 3.424 3.132 2.969 3.237 . 0 0 "[ . 1 . 2]" 1
565 1 49 LEU H 1 49 LEU MD2 3.086 2.529 3.765 3.840 3.751 3.890 0.125 19 0 "[ . 1 . 2]" 1
566 1 49 LEU H 1 49 LEU HG 2.661 2.284 3.101 2.515 2.268 2.600 0.016 3 0 "[ . 1 . 2]" 1
567 1 49 LEU H 1 50 VAL H 2.868 2.461 3.342 2.695 2.602 2.749 . 0 0 "[ . 1 . 2]" 1
568 1 49 LEU H 1 50 VAL H 2.645 2.270 3.082 2.664 2.577 2.705 . 0 0 "[ . 1 . 2]" 1
569 1 49 LEU H 1 50 VAL HB 4.062 3.486 4.733 4.651 4.582 4.685 . 0 0 "[ . 1 . 2]" 1
570 1 49 LEU H 1 51 ASP H 4.394 3.771 5.120 3.909 3.834 4.006 . 0 0 "[ . 1 . 2]" 1
571 1 49 LEU H 1 51 ASP H 2.871 2.464 3.346 2.518 2.422 2.662 0.042 17 0 "[ . 1 . 2]" 1
572 1 49 LEU HA 1 49 LEU MD1 3.233 2.650 3.945 3.815 3.795 3.886 . 0 0 "[ . 1 . 2]" 1
573 1 49 LEU HA 1 49 LEU QD 2.240 . 2.733 2.203 2.159 2.245 . 0 0 "[ . 1 . 2]" 1
574 1 49 LEU HA 1 49 LEU MD2 2.258 . 2.755 2.217 2.172 2.259 . 0 0 "[ . 1 . 2]" 1
575 1 49 LEU HA 1 50 VAL H 3.412 3.028 3.976 3.579 3.565 3.593 . 0 0 "[ . 1 . 2]" 1
576 1 49 LEU HA 1 51 ASP H 4.369 3.749 5.091 3.872 3.804 3.943 . 0 0 "[ . 1 . 2]" 1
577 1 49 LEU HA 1 52 THR H 2.278 . 2.655 2.635 2.575 2.697 0.042 6 0 "[ . 1 . 2]" 1
578 1 49 LEU HA 1 53 ILE H 2.645 2.270 3.082 2.450 2.334 2.596 . 0 0 "[ . 1 . 2]" 1
579 1 49 LEU HA 1 53 ILE H 3.407 2.792 4.157 4.109 3.888 4.232 0.075 3 0 "[ . 1 . 2]" 1
580 1 49 LEU HB2 1 50 VAL H 2.861 2.455 3.334 2.572 2.513 2.632 . 0 0 "[ . 1 . 2]" 1
581 1 49 LEU HB3 1 50 VAL H 3.343 2.869 3.896 3.368 3.242 3.573 . 0 0 "[ . 1 . 2]" 1
582 1 49 LEU QD 1 52 THR H 3.537 3.035 4.122 3.961 3.820 4.058 . 0 0 "[ . 1 . 2]" 1
583 1 49 LEU MD1 1 85 ARG H 3.285 2.942 3.828 2.993 2.887 3.091 0.055 17 0 "[ . 1 . 2]" 1
584 1 49 LEU MD1 1 85 ARG HA 2.734 2.454 3.336 2.528 2.409 2.837 0.045 15 0 "[ . 1 . 2]" 1
585 1 49 LEU MD1 1 85 ARG QG 2.200 . 2.684 2.170 1.972 2.348 . 0 0 "[ . 1 . 2]" 1
586 1 50 VAL H 1 50 VAL HA 2.764 2.446 3.221 2.837 2.829 2.845 . 0 0 "[ . 1 . 2]" 1
587 1 50 VAL H 1 50 VAL HB 2.233 . 2.602 2.341 2.284 2.369 . 0 0 "[ . 1 . 2]" 1
588 1 50 VAL H 1 50 VAL MG1 3.269 2.679 3.989 3.734 3.709 3.741 . 0 0 "[ . 1 . 2]" 1
589 1 50 VAL H 1 50 VAL MG2 2.294 . 2.673 2.366 2.285 2.501 . 0 0 "[ . 1 . 2]" 1
590 1 50 VAL H 1 51 ASP H 2.987 2.563 3.168 2.666 2.625 2.696 . 0 0 "[ . 1 . 2]" 1
591 1 50 VAL H 1 52 THR H 3.994 3.428 4.654 4.195 4.032 4.437 . 0 0 "[ . 1 . 2]" 1
592 1 50 VAL H 1 53 ILE HB 3.007 2.581 3.504 3.046 2.800 3.309 . 0 0 "[ . 1 . 2]" 1
593 1 50 VAL H 1 53 ILE MD 4.185 3.592 4.877 4.841 4.534 4.948 0.071 17 0 "[ . 1 . 2]" 1
594 1 50 VAL HA 1 51 ASP H 3.752 3.220 3.977 3.509 3.496 3.527 . 0 0 "[ . 1 . 2]" 1
595 1 50 VAL HA 1 52 THR H 4.107 3.525 4.786 4.197 4.034 4.325 . 0 0 "[ . 1 . 2]" 1
596 1 50 VAL HA 1 53 ILE H 3.399 2.786 4.147 3.608 3.475 3.810 . 0 0 "[ . 1 . 2]" 1
597 1 50 VAL HA 1 53 ILE H 2.637 2.263 3.073 2.754 2.729 2.776 . 0 0 "[ . 1 . 2]" 1
598 1 50 VAL HA 1 53 ILE MD 2.838 2.326 3.463 2.948 2.634 3.094 . 0 0 "[ . 1 . 2]" 1
599 1 50 VAL HA 1 53 ILE HB 2.784 2.282 3.397 2.351 2.275 2.462 0.007 18 0 "[ . 1 . 2]" 1
600 1 50 VAL HA 1 53 ILE MD 2.966 2.431 3.619 3.082 2.684 3.287 . 0 0 "[ . 1 . 2]" 1
601 1 50 VAL HA 1 92 LEU QD 2.978 2.441 3.566 3.033 2.775 3.389 . 0 0 "[ . 1 . 2]" 1
602 1 50 VAL HB 1 51 ASP H 2.677 2.297 3.119 2.860 2.807 2.912 . 0 0 "[ . 1 . 2]" 1
603 1 50 VAL MG1 1 51 ASP H 3.112 2.671 3.626 3.345 3.263 3.397 . 0 0 "[ . 1 . 2]" 1
604 1 50 VAL MG1 1 51 ASP HA 3.241 2.709 3.954 3.343 3.274 3.394 . 0 0 "[ . 1 . 2]" 1
605 1 50 VAL MG1 1 54 ARG H 3.576 3.069 4.167 3.306 3.180 3.409 . 0 0 "[ . 1 . 2]" 1
606 1 50 VAL MG1 1 91 GLN HE22 4.187 3.593 4.879 4.176 3.514 4.919 0.079 7 0 "[ . 1 . 2]" 1
607 1 50 VAL MG2 1 51 ASP H 3.448 2.959 4.018 4.065 4.030 4.122 0.104 18 0 "[ . 1 . 2]" 1
608 1 50 VAL MG2 1 87 ALA MB 4.048 3.318 4.269 4.362 4.292 4.453 0.184 19 0 "[ . 1 . 2]" 1
609 1 50 VAL MG2 1 88 ALA H 4.230 3.630 4.929 3.996 3.947 4.057 . 0 0 "[ . 1 . 2]" 1
610 1 50 VAL MG2 1 88 ALA HA 2.417 . 2.949 2.065 2.017 2.167 . 0 0 "[ . 1 . 2]" 1
611 1 50 VAL MG2 1 88 ALA MB 2.370 . 2.821 1.944 1.912 2.029 0.030 4 0 "[ . 1 . 2]" 1
612 1 50 VAL MG2 1 91 GLN H 4.275 3.669 4.982 4.417 4.172 4.710 . 0 0 "[ . 1 . 2]" 1
613 1 50 VAL MG2 1 91 GLN HB2 3.062 2.510 3.736 3.736 3.234 4.120 0.384 12 0 "[ . 1 . 2]" 1
614 1 50 VAL MG2 1 91 GLN HE21 4.946 4.245 5.762 4.845 4.560 5.011 . 0 0 "[ . 1 . 2]" 1
615 1 50 VAL MG2 1 91 GLN HE22 4.926 4.228 5.740 4.260 4.180 4.553 0.048 8 0 "[ . 1 . 2]" 1
616 1 50 VAL MG2 1 91 GLN HG2 3.487 2.858 4.254 4.060 3.221 4.915 0.661 14 3 "[ * . - 1 +. 2]" 1
617 1 50 VAL MG2 1 92 LEU H . 3.512 4.165 4.156 3.808 4.244 0.079 3 0 "[ . 1 . 2]" 1
618 1 51 ASP H 1 51 ASP HA 2.723 2.337 3.173 2.772 2.756 2.795 . 0 0 "[ . 1 . 2]" 1
619 1 51 ASP H 1 51 ASP HB2 2.916 2.503 3.398 2.330 2.226 2.415 0.277 5 0 "[ . 1 . 2]" 1
620 1 51 ASP H 1 51 ASP HB3 2.630 2.257 3.065 3.107 2.740 3.552 0.487 10 0 "[ . 1 . 2]" 1
621 1 51 ASP H 1 52 THR H 2.638 2.264 3.074 2.525 2.430 2.674 . 0 0 "[ . 1 . 2]" 1
622 1 51 ASP H 1 53 ILE H 4.787 4.108 5.578 4.248 4.167 4.315 . 0 0 "[ . 1 . 2]" 1
623 1 51 ASP HA 1 52 THR H 3.729 3.056 4.550 3.548 3.524 3.576 . 0 0 "[ . 1 . 2]" 1
624 1 51 ASP HA 1 53 ILE H 4.136 3.549 4.820 4.637 4.424 4.794 . 0 0 "[ . 1 . 2]" 1
625 1 51 ASP HA 1 54 ARG H 3.582 3.074 4.174 3.532 3.415 3.645 . 0 0 "[ . 1 . 2]" 1
626 1 51 ASP HA 1 54 ARG HB2 3.093 2.535 3.774 2.655 2.558 2.702 . 0 0 "[ . 1 . 2]" 1
627 1 51 ASP HA 1 54 ARG HB3 3.373 2.765 4.115 3.925 3.872 4.008 . 0 0 "[ . 1 . 2]" 1
628 1 51 ASP HA 1 54 ARG QD 3.440 2.819 4.197 3.752 3.545 4.022 . 0 0 "[ . 1 . 2]" 1
629 1 51 ASP HB2 1 52 THR H 2.984 2.561 3.477 3.298 2.751 3.726 0.249 17 0 "[ . 1 . 2]" 1
630 1 51 ASP HB3 1 52 THR H 2.792 2.396 3.254 2.994 2.423 3.581 0.327 5 0 "[ . 1 . 2]" 1
631 1 52 THR H 1 52 THR HA 2.700 2.333 3.146 2.862 2.840 2.884 . 0 0 "[ . 1 . 2]" 1
632 1 52 THR H 1 52 THR HB 2.355 . 2.873 2.853 2.755 2.918 0.045 13 0 "[ . 1 . 2]" 1
633 1 52 THR H 1 52 THR MG 3.143 2.697 3.663 3.698 3.655 3.738 0.075 3 0 "[ . 1 . 2]" 1
634 1 52 THR H 1 53 ILE H 2.708 2.324 3.153 2.740 2.640 2.827 . 0 0 "[ . 1 . 2]" 1
635 1 52 THR H 1 53 ILE HG13 4.145 3.557 4.830 4.181 4.038 4.316 . 0 0 "[ . 1 . 2]" 1
636 1 52 THR H 1 54 ARG H 4.711 4.043 5.490 4.094 4.019 4.200 0.024 2 0 "[ . 1 . 2]" 1
637 1 52 THR H 1 60 VAL QG 4.640 3.982 5.407 4.550 4.319 4.920 . 0 0 "[ . 1 . 2]" 1
638 1 52 THR HA 1 53 ILE H 3.521 3.022 4.103 3.576 3.555 3.590 . 0 0 "[ . 1 . 2]" 1
639 1 52 THR HA 1 54 ARG H 5.164 4.432 6.018 4.482 4.404 4.642 0.028 20 0 "[ . 1 . 2]" 1
640 1 52 THR HA 1 55 GLU H 3.724 3.196 3.821 3.528 3.323 3.869 0.048 4 0 "[ . 1 . 2]" 1
641 1 52 THR HA 1 55 GLU HB2 3.367 2.760 4.108 3.558 2.654 4.115 0.106 10 0 "[ . 1 . 2]" 1
642 1 52 THR HA 1 55 GLU HB3 3.283 2.691 4.006 3.177 2.740 4.124 0.118 10 0 "[ . 1 . 2]" 1
643 1 52 THR HA 1 56 ASP H 3.298 2.703 4.024 3.526 3.366 3.821 . 0 0 "[ . 1 . 2]" 1
644 1 52 THR HA 1 56 ASP H 3.781 3.245 4.406 3.464 3.302 3.727 . 0 0 "[ . 1 . 2]" 1
645 1 52 THR HB 1 53 ILE H 2.355 . 2.873 2.470 2.352 2.622 . 0 0 "[ . 1 . 2]" 1
646 1 52 THR HB 1 54 ARG H 5.121 4.395 5.968 4.938 4.853 5.034 . 0 0 "[ . 1 . 2]" 1
647 1 52 THR HB 1 60 VAL QG 2.481 2.033 3.027 2.489 2.216 2.846 . 0 0 "[ . 1 . 2]" 1
648 1 52 THR MG 1 53 ILE H 3.330 3.220 3.880 3.787 3.648 3.901 0.021 5 0 "[ . 1 . 2]" 1
649 1 52 THR MG 1 56 ASP H 4.269 3.499 4.749 3.995 3.744 4.443 . 0 0 "[ . 1 . 2]" 1
650 1 52 THR MG 1 56 ASP HB3 3.431 2.812 4.186 3.992 3.407 4.937 0.751 6 4 "[ .+- *1 . *]" 1
651 1 52 THR MG 1 59 SER H 5.000 4.291 5.254 4.274 4.103 4.692 0.188 13 0 "[ . 1 . 2]" 1
652 1 52 THR MG 1 59 SER HB3 2.597 2.129 3.169 3.052 2.292 4.013 0.844 6 4 "[ - .+ 1* . * 2]" 1
653 1 52 THR MG 1 60 VAL H 4.303 3.693 4.506 4.388 3.883 4.559 0.053 17 0 "[ . 1 . 2]" 1
654 1 52 THR MG 1 60 VAL QG 2.464 2.020 2.969 2.076 1.979 2.681 0.041 17 0 "[ . 1 . 2]" 1
655 1 53 ILE H 1 53 ILE HA 2.809 2.302 3.427 2.858 2.836 2.884 . 0 0 "[ . 1 . 2]" 1
656 1 53 ILE H 1 53 ILE HB 2.338 2.006 2.724 2.663 2.638 2.687 . 0 0 "[ . 1 . 2]" 1
657 1 53 ILE H 1 53 ILE MD 3.263 2.674 3.981 3.616 3.538 3.647 . 0 0 "[ . 1 . 2]" 1
658 1 53 ILE H 1 53 ILE HG12 2.497 2.143 2.910 3.007 2.961 3.066 0.156 20 0 "[ . 1 . 2]" 1
659 1 53 ILE H 1 53 ILE HG13 2.465 2.115 2.872 1.959 1.898 1.983 0.217 20 0 "[ . 1 . 2]" 1
660 1 53 ILE H 1 53 ILE MG 3.231 2.648 3.942 3.778 3.765 3.784 . 0 0 "[ . 1 . 2]" 1
661 1 53 ILE H 1 54 ARG H 3.037 2.606 3.104 2.691 2.599 2.751 0.007 5 0 "[ . 1 . 2]" 1
662 1 53 ILE H 1 55 GLU H 4.791 4.112 4.852 4.176 4.040 4.571 0.072 19 0 "[ . 1 . 2]" 1
663 1 53 ILE H 1 92 LEU QD 3.900 3.347 4.545 4.367 4.185 4.484 . 0 0 "[ . 1 . 2]" 1
664 1 53 ILE HA 1 53 ILE HB 3.079 2.524 3.756 3.034 3.030 3.037 . 0 0 "[ . 1 . 2]" 1
665 1 53 ILE HA 1 53 ILE HG12 2.376 . 2.899 2.527 2.492 2.569 . 0 0 "[ . 1 . 2]" 1
666 1 53 ILE HA 1 53 ILE HG13 2.757 2.260 3.364 3.248 3.177 3.298 . 0 0 "[ . 1 . 2]" 1
667 1 53 ILE HA 1 53 ILE MG 2.534 2.233 3.092 2.347 2.300 2.365 . 0 0 "[ . 1 . 2]" 1
668 1 53 ILE HA 1 54 ARG H 3.178 2.605 3.878 3.551 3.544 3.559 . 0 0 "[ . 1 . 2]" 1
669 1 53 ILE HA 1 54 ARG H 3.356 2.880 3.911 3.334 3.270 3.372 . 0 0 "[ . 1 . 2]" 1
670 1 53 ILE HA 1 55 GLU H 4.404 3.779 5.132 4.240 4.165 4.443 . 0 0 "[ . 1 . 2]" 1
671 1 53 ILE HA 1 56 ASP H . 3.826 4.536 3.791 3.722 3.969 0.104 18 0 "[ . 1 . 2]" 1
672 1 53 ILE HA 1 57 PRO HA 2.514 2.060 2.833 2.329 2.293 2.344 . 0 0 "[ . 1 . 2]" 1
673 1 53 ILE HA 1 57 PRO HB3 3.093 2.535 3.774 3.756 3.549 3.856 0.082 6 0 "[ . 1 . 2]" 1
674 1 53 ILE HB 1 53 ILE MD 2.313 . 2.822 2.097 1.925 2.218 . 0 0 "[ . 1 . 2]" 1
675 1 53 ILE HB 1 54 ARG H 2.780 2.384 3.241 2.538 2.496 2.577 . 0 0 "[ . 1 . 2]" 1
676 1 53 ILE HB 1 92 LEU QD 2.441 2.001 2.978 1.984 1.904 2.069 0.097 13 0 "[ . 1 . 2]" 1
677 1 53 ILE MD 1 60 VAL QG . 3.015 3.661 3.151 2.929 3.280 0.086 17 0 "[ . 1 . 2]" 1
678 1 53 ILE MD 1 86 TYR QE 2.910 2.385 3.551 2.562 2.367 2.845 0.018 13 0 "[ . 1 . 2]" 1
679 1 53 ILE MD 1 88 ALA MB 2.441 2.001 2.978 2.330 2.025 2.619 . 0 0 "[ . 1 . 2]" 1
680 1 53 ILE MD 1 89 TYR HA . 3.004 3.626 3.230 3.019 3.596 . 0 0 "[ . 1 . 2]" 1
681 1 53 ILE MD 1 92 LEU QD 2.882 2.362 3.516 2.322 2.267 2.341 0.095 13 0 "[ . 1 . 2]" 1
682 1 53 ILE HG12 1 89 TYR QE 3.040 2.540 3.660 2.693 2.562 2.868 . 0 0 "[ . 1 . 2]" 1
683 1 53 ILE HG13 1 54 ARG H 4.640 3.982 5.407 4.011 3.968 4.058 0.014 19 0 "[ . 1 . 2]" 1
684 1 53 ILE MG 1 54 ARG H 3.396 2.783 4.144 3.620 3.575 3.668 . 0 0 "[ . 1 . 2]" 1
685 1 53 ILE MG 1 57 PRO HA 3.142 2.711 3.834 2.960 2.788 3.169 . 0 0 "[ . 1 . 2]" 1
686 1 53 ILE MG 1 57 PRO HB2 3.717 3.046 4.535 4.004 3.867 4.352 . 0 0 "[ . 1 . 2]" 1
687 1 53 ILE MG 1 57 PRO HB3 3.430 2.811 4.185 2.862 2.771 3.111 0.040 15 0 "[ . 1 . 2]" 1
688 1 53 ILE MG 1 92 LEU QD 2.441 2.001 2.910 2.119 1.962 2.454 0.039 14 0 "[ . 1 . 2]" 1
689 1 54 ARG H 1 54 ARG HA 2.796 2.400 3.258 2.901 2.875 2.910 . 0 0 "[ . 1 . 2]" 1
690 1 54 ARG H 1 54 ARG HB2 2.818 2.310 3.438 2.176 2.144 2.235 0.166 8 0 "[ . 1 . 2]" 1
691 1 54 ARG H 1 54 ARG HB2 2.592 2.225 3.020 2.124 2.113 2.136 0.112 8 0 "[ . 1 . 2]" 1
692 1 54 ARG H 1 54 ARG HB3 2.642 2.267 3.079 3.414 3.362 3.468 0.389 14 0 "[ . 1 . 2]" 1
693 1 54 ARG H 1 54 ARG HG2 3.385 2.774 4.130 4.015 3.539 4.173 0.043 18 0 "[ . 1 . 2]" 1
694 1 54 ARG H 1 54 ARG HG3 2.813 2.306 3.432 3.012 2.711 3.191 . 0 0 "[ . 1 . 2]" 1
695 1 54 ARG H 1 55 GLU H 3.032 2.602 3.376 2.616 2.559 2.812 0.043 17 0 "[ . 1 . 2]" 1
696 1 54 ARG H 1 56 ASP H 4.542 3.898 5.173 4.028 3.869 4.150 0.029 4 0 "[ . 1 . 2]" 1
697 1 54 ARG H 1 92 LEU QD 3.917 3.362 4.565 3.621 3.431 3.786 . 0 0 "[ . 1 . 2]" 1
698 1 54 ARG HA 1 54 ARG QD 3.455 2.832 4.216 3.974 3.774 4.082 . 0 0 "[ . 1 . 2]" 1
699 1 54 ARG HA 1 55 GLU H 3.749 3.217 4.330 3.558 3.524 3.597 . 0 0 "[ . 1 . 2]" 1
700 1 54 ARG HA 1 92 LEU QD 3.888 3.187 4.383 3.792 3.563 4.140 . 0 0 "[ . 1 . 2]" 1
701 1 54 ARG HB2 1 55 GLU H 3.200 2.746 3.729 2.876 2.667 3.099 0.079 8 0 "[ . 1 . 2]" 1
702 1 54 ARG HB3 1 55 GLU H 3.314 2.716 4.043 3.311 2.755 3.657 . 0 0 "[ . 1 . 2]" 1
703 1 54 ARG HB3 1 55 GLU H 2.547 2.186 2.968 2.376 2.173 2.570 0.013 8 0 "[ . 1 . 2]" 1
704 1 54 ARG QD 1 92 LEU QD 2.949 2.417 3.598 2.762 2.364 3.324 0.053 3 0 "[ . 1 . 2]" 1
705 1 54 ARG HG2 1 55 GLU H 4.945 4.244 5.762 5.054 4.802 5.201 . 0 0 "[ . 1 . 2]" 1
706 1 55 GLU H 1 55 GLU HA 2.820 2.420 3.286 2.900 2.798 2.958 . 0 0 "[ . 1 . 2]" 1
707 1 55 GLU H 1 55 GLU HB2 2.787 2.284 3.400 2.440 2.246 2.627 0.038 9 0 "[ . 1 . 2]" 1
708 1 55 GLU H 1 55 GLU HB3 3.107 2.666 3.621 2.903 2.523 3.571 0.143 14 0 "[ . 1 . 2]" 1
709 1 55 GLU H 1 55 GLU QG 3.401 2.919 3.963 3.810 2.859 4.076 0.113 2 0 "[ . 1 . 2]" 1
710 1 55 GLU H 1 56 ASP H 2.533 2.175 2.952 2.535 2.322 2.844 . 0 0 "[ . 1 . 2]" 1
711 1 55 GLU HA 1 56 ASP H 3.558 3.053 4.115 3.536 3.491 3.569 . 0 0 "[ . 1 . 2]" 1
712 1 55 GLU HB2 1 56 ASP H 3.120 2.678 3.636 3.601 2.773 3.908 0.272 14 0 "[ . 1 . 2]" 1
713 1 55 GLU HB3 1 56 ASP H 3.288 2.822 3.832 2.911 2.622 3.685 0.200 14 0 "[ . 1 . 2]" 1
714 1 55 GLU HG3 1 56 ASP H 4.621 3.966 5.385 4.845 3.923 5.314 0.043 3 0 "[ . 1 . 2]" 1
715 1 56 ASP H 1 56 ASP HA 3.215 2.759 3.540 2.917 2.876 2.952 . 0 0 "[ . 1 . 2]" 1
716 1 56 ASP H 1 56 ASP HB2 3.544 3.042 4.130 3.250 2.874 3.844 0.168 11 0 "[ . 1 . 2]" 1
717 1 56 ASP H 1 56 ASP HB3 3.331 2.859 3.882 3.357 3.004 3.972 0.090 17 0 "[ . 1 . 2]" 1
718 1 56 ASP H 1 57 PRO HD2 3.836 3.292 4.470 4.335 4.072 4.582 0.112 6 0 "[ . 1 . 2]" 1
719 1 56 ASP H 1 57 PRO HD3 3.455 2.965 4.026 3.644 3.358 3.968 . 0 0 "[ . 1 . 2]" 1
720 1 56 ASP H 1 58 ASP H 5.628 4.830 6.170 5.229 5.047 5.429 . 0 0 "[ . 1 . 2]" 1
721 1 56 ASP HA 1 57 PRO HD2 2.297 . 2.803 2.152 2.084 2.224 . 0 0 "[ . 1 . 2]" 1
722 1 56 ASP HA 1 57 PRO HD3 2.582 2.116 3.150 2.741 2.538 2.916 . 0 0 "[ . 1 . 2]" 1
723 1 56 ASP HA 1 57 PRO HG3 3.743 3.068 4.567 4.641 4.591 4.686 0.119 17 0 "[ . 1 . 2]" 1
724 1 56 ASP HA 1 58 ASP H 3.901 3.348 3.939 3.577 3.394 3.745 . 0 0 "[ . 1 . 2]" 1
725 1 56 ASP HA 1 59 SER H 4.815 4.132 5.611 4.475 4.082 4.832 0.050 18 0 "[ . 1 . 2]" 1
726 1 57 PRO HA 1 58 ASP H 3.875 3.326 4.323 3.477 3.396 3.537 . 0 0 "[ . 1 . 2]" 1
727 1 57 PRO HA 1 59 SER H 4.205 3.609 4.495 3.801 3.595 4.483 0.014 4 0 "[ . 1 . 2]" 1
728 1 57 PRO HA 1 60 VAL H . 4.502 4.536 4.437 4.385 4.462 0.117 17 0 "[ . 1 . 2]" 1
729 1 57 PRO HB2 1 58 ASP H 3.422 2.937 3.988 3.478 3.278 3.683 . 0 0 "[ . 1 . 2]" 1
730 1 57 PRO HB3 1 58 ASP H 2.553 2.191 2.975 2.451 2.292 2.709 . 0 0 "[ . 1 . 2]" 1
731 1 57 PRO HD2 1 58 ASP H 3.489 2.994 4.066 2.961 2.818 3.146 0.176 20 0 "[ . 1 . 2]" 1
732 1 57 PRO HD3 1 58 ASP H 3.849 3.303 4.485 4.061 3.995 4.148 . 0 0 "[ . 1 . 2]" 1
733 1 57 PRO HG2 1 58 ASP H 3.196 2.743 3.724 2.974 2.770 3.221 . 0 0 "[ . 1 . 2]" 1
734 1 58 ASP H 1 58 ASP HA 2.887 2.478 3.364 2.961 2.931 2.969 . 0 0 "[ . 1 . 2]" 1
735 1 58 ASP H 1 59 SER H 2.874 2.475 3.349 2.438 2.389 2.469 0.086 3 0 "[ . 1 . 2]" 1
736 1 58 ASP H 1 60 VAL H 4.787 4.167 5.578 4.383 4.112 4.517 0.055 13 0 "[ . 1 . 2]" 1
737 1 58 ASP HA 1 59 SER H 3.593 3.083 4.187 3.325 3.237 3.544 . 0 0 "[ . 1 . 2]" 1
738 1 58 ASP HA 1 60 VAL H 3.723 3.051 4.542 3.422 3.227 3.604 . 0 0 "[ . 1 . 2]" 1
739 1 58 ASP QB 1 59 SER H 3.461 2.970 4.033 3.470 2.841 3.899 0.129 13 0 "[ . 1 . 2]" 1
740 1 59 SER H 1 59 SER HA 2.974 2.558 3.466 2.972 2.872 3.009 . 0 0 "[ . 1 . 2]" 1
741 1 59 SER H 1 59 SER QB 2.835 2.433 3.304 2.459 2.395 2.748 0.038 4 0 "[ . 1 . 2]" 1
742 1 59 SER H 1 60 VAL H 2.814 2.415 3.205 2.574 2.442 2.903 . 0 0 "[ . 1 . 2]" 1
743 1 59 SER HA 1 60 VAL H 3.810 3.270 4.235 3.171 3.108 3.257 0.162 3 0 "[ . 1 . 2]" 1
744 1 59 SER QB 1 60 VAL H 4.051 3.477 4.721 3.621 3.525 3.916 . 0 0 "[ . 1 . 2]" 1
745 1 60 VAL H 1 60 VAL HA 3.403 2.920 3.790 2.992 2.952 3.004 . 0 0 "[ . 1 . 2]" 1
746 1 60 VAL H 1 60 VAL HB 2.553 2.191 2.975 2.901 2.801 3.203 0.228 19 0 "[ . 1 . 2]" 1
747 1 60 VAL H 1 60 VAL QG . 3.025 3.099 2.333 2.222 2.531 0.803 13 19 "[*** -*******+*******]" 1
748 1 60 VAL HA 1 60 VAL QG 2.788 2.483 3.260 2.143 2.089 2.313 0.394 6 0 "[ . 1 . 2]" 1
749 1 60 VAL HA 1 61 PRO HD2 2.556 2.095 3.119 2.339 2.253 2.477 . 0 0 "[ . 1 . 2]" 1
750 1 60 VAL HA 1 61 PRO HD3 2.403 . 2.932 2.345 2.274 2.465 . 0 0 "[ . 1 . 2]" 1
751 1 60 VAL HB 1 89 TYR QD 3.356 2.801 4.034 3.145 2.853 3.483 . 0 0 "[ . 1 . 2]" 1
752 1 60 VAL HB 1 89 TYR QE 4.313 3.600 5.185 3.775 3.572 4.366 0.028 9 0 "[ . 1 . 2]" 1
753 1 60 VAL QG 1 61 PRO HD2 . 2.644 3.000 2.952 2.056 3.094 0.588 14 2 "[ .- 1 +. 2]" 1
754 1 60 VAL QG 1 85 ARG HD2 3.500 2.869 4.270 4.140 3.491 4.321 0.051 6 0 "[ . 1 . 2]" 1
755 1 60 VAL QG 1 85 ARG HD3 3.409 2.794 4.159 3.891 3.437 4.267 0.108 14 0 "[ . 1 . 2]" 1
756 1 60 VAL QG 1 89 TYR QD 3.958 3.304 4.758 3.632 3.296 4.123 0.008 18 0 "[ . 1 . 2]" 1
757 1 60 VAL QG 1 89 TYR QE 3.132 2.614 3.765 3.335 2.990 3.725 . 0 0 "[ . 1 . 2]" 1
758 1 61 PRO HA 1 62 PRO HD2 2.435 . 2.971 2.595 2.462 3.019 0.048 3 0 "[ . 1 . 2]" 1
759 1 61 PRO HA 1 62 PRO HD3 2.340 . 2.855 2.299 2.126 2.362 . 0 0 "[ . 1 . 2]" 1
760 1 61 PRO HB2 1 62 PRO HD2 2.942 2.411 3.590 2.865 2.292 3.367 0.119 5 0 "[ . 1 . 2]" 1
761 1 61 PRO HB3 1 62 PRO HD2 2.595 2.455 3.166 2.651 2.305 3.201 0.150 3 0 "[ . 1 . 2]" 1
762 1 61 PRO HB3 1 62 PRO HD3 2.961 2.668 3.613 3.647 2.930 4.047 0.434 6 0 "[ . 1 . 2]" 1
763 1 62 PRO HA 1 63 ILE H 2.068 . 2.410 2.451 2.380 2.486 0.076 17 0 "[ . 1 . 2]" 1
764 1 62 PRO HA 1 63 ILE MD 3.397 2.784 4.145 3.982 3.967 3.996 . 0 0 "[ . 1 . 2]" 1
765 1 62 PRO HB2 1 63 ILE H 2.955 2.536 3.443 2.744 2.499 3.274 0.037 3 0 "[ . 1 . 2]" 1
766 1 62 PRO HB2 1 99 ALA H 3.514 3.016 4.095 3.514 3.389 3.720 . 0 0 "[ . 1 . 2]" 1
767 1 62 PRO HB2 1 99 ALA HA 2.744 2.249 3.348 2.861 2.477 3.694 0.346 5 0 "[ . 1 . 2]" 1
768 1 62 PRO HB2 1 100 LYS H 3.105 2.665 3.618 2.685 2.197 3.344 0.468 20 0 "[ . 1 . 2]" 1
769 1 62 PRO HB3 1 63 ILE H 2.889 2.479 3.366 3.325 2.714 3.554 0.188 16 0 "[ . 1 . 2]" 1
770 1 62 PRO HB3 1 99 ALA HA 3.057 2.506 3.729 3.176 2.343 3.752 0.163 13 0 "[ . 1 . 2]" 1
771 1 63 ILE H 1 63 ILE HA 3.135 2.570 3.825 3.000 2.991 3.007 . 0 0 "[ . 1 . 2]" 1
772 1 63 ILE H 1 63 ILE HB 3.463 2.972 4.035 3.662 3.632 3.704 . 0 0 "[ . 1 . 2]" 1
773 1 63 ILE H 1 63 ILE MD 3.039 2.733 3.541 3.658 3.604 3.733 0.192 18 0 "[ . 1 . 2]" 1
774 1 63 ILE H 1 63 ILE HG12 2.274 . 2.650 2.121 1.971 2.208 . 0 0 "[ . 1 . 2]" 1
775 1 63 ILE H 1 63 ILE HG13 2.690 2.309 3.135 2.244 2.060 2.410 0.249 13 0 "[ . 1 . 2]" 1
776 1 63 ILE H 1 63 ILE MG 2.743 2.249 3.347 2.939 2.771 3.124 . 0 0 "[ . 1 . 2]" 1
777 1 63 ILE H 1 64 ASP H 4.188 3.594 4.880 4.548 4.509 4.576 . 0 0 "[ . 1 . 2]" 1
778 1 63 ILE H 1 99 ALA HA 2.428 2.063 2.801 2.100 2.022 2.218 0.041 17 0 "[ . 1 . 2]" 1
779 1 63 ILE H 1 100 LYS H 3.457 2.967 3.946 3.154 2.956 3.414 0.011 15 0 "[ . 1 . 2]" 1
780 1 63 ILE HA 1 63 ILE MD 3.481 2.853 4.247 4.133 4.119 4.151 . 0 0 "[ . 1 . 2]" 1
781 1 63 ILE HA 1 63 ILE MG 2.383 2.031 2.907 2.296 2.222 2.346 . 0 0 "[ . 1 . 2]" 1
782 1 63 ILE HA 1 64 ASP H 2.225 . 2.593 2.464 2.404 2.526 . 0 0 "[ . 1 . 2]" 1
783 1 63 ILE HA 1 100 LYS H 3.933 3.375 4.583 4.629 4.558 4.680 0.097 3 0 "[ . 1 . 2]" 1
784 1 63 ILE HB 1 64 ASP H 2.535 2.176 2.954 2.459 2.346 2.608 . 0 0 "[ . 1 . 2]" 1
785 1 63 ILE MD 1 99 ALA MB 2.357 . 2.876 2.041 1.981 2.188 . 0 0 "[ . 1 . 2]" 1
786 1 63 ILE MD 1 64 ASP H 3.459 2.969 4.031 4.090 4.054 4.135 0.104 6 0 "[ . 1 . 2]" 1
787 1 63 ILE MD 1 100 LYS H 3.776 3.241 4.400 3.928 3.776 4.148 . 0 0 "[ . 1 . 2]" 1
788 1 63 ILE HG12 1 64 ASP H 3.025 2.596 3.525 3.458 3.319 3.583 0.058 12 0 "[ . 1 . 2]" 1
789 1 63 ILE HG12 1 100 LYS H 2.547 2.186 2.968 2.872 2.778 3.043 0.075 8 0 "[ . 1 . 2]" 1
790 1 63 ILE HG13 1 64 ASP H 4.705 4.038 5.483 4.048 3.978 4.138 0.060 20 0 "[ . 1 . 2]" 1
791 1 63 ILE HG13 1 99 ALA MB 3.051 2.501 3.723 2.365 2.167 2.610 0.334 11 0 "[ . 1 . 2]" 1
792 1 63 ILE MG 1 64 ASP H 3.257 2.669 3.974 3.530 3.371 3.665 . 0 0 "[ . 1 . 2]" 1
793 1 63 ILE MG 1 82 GLY H 3.736 3.206 4.354 3.661 3.330 3.959 . 0 0 "[ . 1 . 2]" 1
794 1 63 ILE MG 1 82 GLY HA2 . 2.340 2.720 2.921 2.787 3.101 0.381 17 0 "[ . 1 . 2]" 1
795 1 63 ILE MG 1 82 GLY HA3 . 2.507 3.017 2.359 2.246 2.450 0.261 10 0 "[ . 1 . 2]" 1
796 1 63 ILE MG 1 85 ARG HB2 2.823 2.314 3.444 3.153 2.868 3.477 0.033 8 0 "[ . 1 . 2]" 1
797 1 63 ILE MG 1 85 ARG HB3 3.040 2.492 3.709 3.437 3.164 3.746 0.037 8 0 "[ . 1 . 2]" 1
798 1 63 ILE MG 1 85 ARG HD2 3.213 2.633 3.920 3.063 2.586 3.842 0.047 11 0 "[ . 1 . 2]" 1
799 1 64 ASP H 1 64 ASP HA 2.866 2.460 3.340 2.945 2.920 2.968 . 0 0 "[ . 1 . 2]" 1
800 1 64 ASP H 1 64 ASP HB2 2.836 2.434 3.305 2.812 2.244 3.537 0.232 14 0 "[ . 1 . 2]" 1
801 1 64 ASP H 1 64 ASP HB3 2.501 2.148 2.914 2.712 2.384 3.542 0.628 18 1 "[ . 1 . + 2]" 1
802 1 64 ASP H 1 65 VAL H 3.878 3.328 4.519 4.574 4.482 4.602 0.083 17 0 "[ . 1 . 2]" 1
803 1 64 ASP H 1 65 VAL H 3.984 3.419 4.643 4.191 4.153 4.245 . 0 0 "[ . 1 . 2]" 1
804 1 64 ASP H 1 100 LYS H 3.855 3.308 4.492 4.152 4.044 4.243 . 0 0 "[ . 1 . 2]" 1
805 1 64 ASP HA 1 65 VAL H 2.025 . 2.360 2.214 2.179 2.252 . 0 0 "[ . 1 . 2]" 1
806 1 64 ASP HA 1 100 LYS HB2 2.884 2.364 3.519 3.361 2.348 3.666 0.147 9 0 "[ . 1 . 2]" 1
807 1 64 ASP HA 1 100 LYS HB3 2.715 2.225 3.313 2.982 2.567 3.655 0.342 7 0 "[ . 1 . 2]" 1
808 1 64 ASP HB2 1 65 VAL H 3.317 2.847 3.865 4.019 3.189 4.316 0.451 6 0 "[ . 1 . 2]" 1
809 1 64 ASP HB3 1 65 VAL H 3.730 3.201 4.347 3.952 3.203 4.188 . 0 0 "[ . 1 . 2]" 1
810 1 65 VAL H 1 65 VAL HA 3.150 2.582 3.843 2.975 2.966 3.005 . 0 0 "[ . 1 . 2]" 1
811 1 65 VAL H 1 65 VAL HB 2.444 2.097 2.848 2.686 2.495 2.743 . 0 0 "[ . 1 . 2]" 1
812 1 65 VAL H 1 65 VAL MG1 3.634 3.119 4.234 3.760 3.681 3.821 . 0 0 "[ . 1 . 2]" 1
813 1 65 VAL H 1 65 VAL MG2 3.010 2.583 3.508 3.339 3.232 3.484 . 0 0 "[ . 1 . 2]" 1
814 1 65 VAL H 1 66 LEU H 3.972 3.409 4.629 4.306 4.242 4.397 . 0 0 "[ . 1 . 2]" 1
815 1 65 VAL H 1 101 LEU MD2 3.946 3.386 4.598 4.650 4.599 4.708 0.110 10 0 "[ . 1 . 2]" 1
816 1 65 VAL H 1 102 VAL MG1 4.045 3.315 4.935 5.207 4.993 5.474 0.539 3 2 "[ + . 1 . - 2]" 1
817 1 65 VAL H 1 102 VAL QG 3.637 3.121 4.238 3.157 3.039 3.274 0.082 20 0 "[ . 1 . 2]" 1
818 1 65 VAL HA 1 66 LEU H 2.287 . 2.790 2.222 2.192 2.252 . 0 0 "[ . 1 . 2]" 1
819 1 65 VAL HA 1 79 SER HA 2.381 2.076 2.905 2.939 2.900 2.991 0.086 13 0 "[ . 1 . 2]" 1
820 1 65 VAL HB 1 99 ALA MB 3.075 2.520 3.752 2.617 2.478 2.822 0.042 3 0 "[ . 1 . 2]" 1
821 1 65 VAL HB 1 101 LEU H 2.557 2.194 2.980 2.582 2.561 2.597 . 0 0 "[ . 1 . 2]" 1
822 1 65 VAL HB 1 101 LEU MD2 2.718 2.228 3.316 2.736 2.685 2.785 . 0 0 "[ . 1 . 2]" 1
823 1 65 VAL MG1 1 66 LEU H 2.627 2.502 3.061 2.502 2.446 2.625 0.056 17 0 "[ . 1 . 2]" 1
824 1 65 VAL MG1 1 77 PHE HA 2.693 2.553 3.300 3.316 3.244 3.405 0.105 20 0 "[ . 1 . 2]" 1
825 1 65 VAL MG1 1 77 PHE HB2 3.078 2.523 3.756 3.894 3.825 3.956 0.200 14 0 "[ . 1 . 2]" 1
826 1 65 VAL MG1 1 77 PHE HB3 3.406 2.792 4.156 2.495 2.453 2.560 0.339 5 0 "[ . 1 . 2]" 1
827 1 65 VAL MG1 1 78 TYR H 2.881 2.631 3.357 2.934 2.772 3.071 . 0 0 "[ . 1 . 2]" 1
828 1 65 VAL MG1 1 101 LEU MD1 3.913 3.207 4.774 4.567 4.348 4.795 0.021 13 0 "[ . 1 . 2]" 1
829 1 65 VAL MG1 1 101 LEU MD2 2.815 2.307 3.434 2.551 2.314 2.750 . 0 0 "[ . 1 . 2]" 1
830 1 65 VAL MG2 1 66 LEU H 3.142 2.696 3.661 3.680 3.540 3.737 0.076 6 0 "[ . 1 . 2]" 1
831 1 65 VAL MG2 1 79 SER HA 2.901 2.378 3.539 2.377 2.359 2.417 0.019 12 0 "[ . 1 . 2]" 1
832 1 65 VAL MG2 1 79 SER HB3 3.162 2.592 3.858 3.931 3.694 4.102 0.244 18 0 "[ . 1 . 2]" 1
833 1 65 VAL MG2 1 80 PHE H 3.364 2.887 3.920 4.016 3.976 4.040 0.120 13 0 "[ . 1 . 2]" 1
834 1 65 VAL MG2 1 99 ALA MB 2.272 . 2.772 2.149 2.026 2.341 . 0 0 "[ . 1 . 2]" 1
835 1 65 VAL MG2 1 101 LEU MD2 3.282 2.690 4.004 3.803 3.632 3.958 . 0 0 "[ . 1 . 2]" 1
836 1 66 LEU H 1 66 LEU HA 2.985 2.562 3.478 2.957 2.942 2.968 . 0 0 "[ . 1 . 2]" 1
837 1 66 LEU H 1 66 LEU HB2 2.443 2.097 2.847 2.208 2.192 2.248 . 0 0 "[ . 1 . 2]" 1
838 1 66 LEU H 1 66 LEU HB3 3.332 2.860 3.883 3.509 3.485 3.589 . 0 0 "[ . 1 . 2]" 1
839 1 66 LEU H 1 66 LEU MD1 3.126 2.828 3.643 2.772 2.688 3.290 0.140 4 0 "[ . 1 . 2]" 1
840 1 66 LEU H 1 66 LEU MD2 4.299 3.523 5.226 4.262 4.084 4.339 . 0 0 "[ . 1 . 2]" 1
841 1 66 LEU H 1 67 TRP H 4.159 3.569 4.847 4.569 4.540 4.595 . 0 0 "[ . 1 . 2]" 1
842 1 66 LEU H 1 67 TRP H 3.366 2.889 3.922 3.688 3.652 3.708 . 0 0 "[ . 1 . 2]" 1
843 1 66 LEU H 1 78 TYR HB2 3.609 3.097 4.206 3.549 3.270 3.981 . 0 0 "[ . 1 . 2]" 1
844 1 66 LEU H 1 78 TYR HB3 4.113 3.530 4.793 4.256 4.078 4.623 . 0 0 "[ . 1 . 2]" 1
845 1 66 LEU H 1 80 PHE H 5.000 4.500 1004.000 4.454 4.396 4.544 0.104 17 0 "[ . 1 . 2]" 1
846 1 66 LEU H 1 80 PHE QD 4.275 3.669 4.982 4.847 4.613 5.057 0.075 3 0 "[ . 1 . 2]" 1
847 1 66 LEU HA 1 66 LEU MD1 3.425 2.807 4.179 2.895 2.752 3.794 0.055 18 0 "[ . 1 . 2]" 1
848 1 66 LEU HA 1 66 LEU MD2 2.807 2.301 3.424 3.480 2.284 3.628 0.204 5 0 "[ . 1 . 2]" 1
849 1 66 LEU HA 1 66 LEU MD2 2.337 . 2.851 2.900 2.230 3.045 0.194 18 0 "[ . 1 . 2]" 1
850 1 66 LEU HA 1 67 TRP H 2.094 . 2.440 2.200 2.179 2.238 . 0 0 "[ . 1 . 2]" 1
851 1 66 LEU HA 1 67 TRP HE3 4.563 3.809 5.485 4.881 4.788 4.968 . 0 0 "[ . 1 . 2]" 1
852 1 66 LEU HA 1 77 PHE QD 4.300 3.589 5.169 4.525 4.468 4.592 . 0 0 "[ . 1 . 2]" 1
853 1 66 LEU HA 1 102 VAL MG1 3.624 2.970 4.422 3.327 3.184 3.625 . 0 0 "[ . 1 . 2]" 1
854 1 66 LEU HA 1 102 VAL MG2 3.903 3.199 4.762 3.371 3.258 3.436 . 0 0 "[ . 1 . 2]" 1
855 1 66 LEU HA 1 102 VAL HB 2.740 2.246 3.343 2.345 2.322 2.396 . 0 0 "[ . 1 . 2]" 1
856 1 66 LEU HB2 1 67 TRP H 3.871 3.322 4.511 3.514 3.438 3.920 . 0 0 "[ . 1 . 2]" 1
857 1 66 LEU HB2 1 80 PHE QD 3.513 2.932 4.223 4.111 3.954 4.252 0.029 8 0 "[ . 1 . 2]" 1
858 1 66 LEU HB2 1 80 PHE QE 3.456 2.885 4.154 3.241 2.989 3.620 . 0 0 "[ . 1 . 2]" 1
859 1 66 LEU HB2 1 80 PHE HZ 4.132 3.449 4.967 4.238 4.097 4.427 . 0 0 "[ . 1 . 2]" 1
860 1 66 LEU HB3 1 67 TRP H 3.340 2.866 3.892 3.246 3.115 3.331 . 0 0 "[ . 1 . 2]" 1
861 1 66 LEU QD 1 80 PHE H 3.608 3.096 4.204 4.184 3.991 4.290 0.086 3 0 "[ . 1 . 2]" 1
862 1 66 LEU QD 1 104 SER HA 3.236 2.652 3.948 3.851 3.653 3.953 0.005 18 0 "[ . 1 . 2]" 1
863 1 66 LEU QD 1 104 SER HB2 2.481 2.033 3.027 2.627 2.490 2.801 . 0 0 "[ . 1 . 2]" 1
864 1 66 LEU QD 1 104 SER HB3 2.521 2.066 3.076 2.861 2.646 3.079 0.003 18 0 "[ . 1 . 2]" 1
865 1 66 LEU QD 1 109 LEU MD1 2.393 . 2.920 2.526 2.208 2.951 0.031 3 0 "[ . 1 . 2]" 1
866 1 66 LEU QD 1 109 LEU MD2 2.812 2.305 3.431 2.315 2.114 2.739 0.191 16 0 "[ . 1 . 2]" 1
867 1 66 LEU QD 1 112 TYR H 2.975 2.553 3.467 3.622 3.590 3.651 0.184 3 0 "[ . 1 . 2]" 1
868 1 66 LEU MD1 1 78 TYR QD 3.340 2.788 4.015 3.273 3.037 3.498 . 0 0 "[ . 1 . 2]" 1
869 1 66 LEU MD1 1 78 TYR QE 2.834 2.366 3.407 2.973 2.538 3.284 . 0 0 "[ . 1 . 2]" 1
870 1 66 LEU MD1 1 80 PHE QD 2.960 2.426 3.612 2.553 2.412 2.728 0.014 17 0 "[ . 1 . 2]" 1
871 1 66 LEU MD1 1 80 PHE QD 2.836 2.367 3.409 2.528 2.396 2.680 . 0 0 "[ . 1 . 2]" 1
872 1 66 LEU MD1 1 80 PHE QE 2.918 2.436 3.508 2.393 2.237 2.523 0.199 13 0 "[ . 1 . 2]" 1
873 1 66 LEU MD1 1 80 PHE HZ 3.191 2.664 3.836 2.741 2.626 2.895 0.038 19 0 "[ . 1 . 2]" 1
874 1 66 LEU MD1 1 109 LEU QD 3.301 2.706 4.027 3.878 2.962 4.099 0.072 17 0 "[ . 1 . 2]" 1
875 1 66 LEU MD1 1 112 TYR QD 3.299 2.754 3.966 3.790 3.198 4.015 0.049 5 0 "[ . 1 . 2]" 1
876 1 66 LEU MD1 1 112 TYR QE 3.180 2.654 3.823 3.171 2.657 3.414 . 0 0 "[ . 1 . 2]" 1
877 1 66 LEU MD1 1 112 TYR QR 3.183 2.609 3.884 3.107 2.559 3.372 0.050 3 0 "[ . 1 . 2]" 1
878 1 66 LEU MD2 1 67 TRP H 3.484 2.856 4.251 4.223 3.288 4.374 0.123 10 0 "[ . 1 . 2]" 1
879 1 66 LEU MD2 1 67 TRP H 3.077 2.641 3.586 3.391 3.051 3.479 . 0 0 "[ . 1 . 2]" 1
880 1 67 TRP H 1 67 TRP HA 3.026 2.661 3.526 3.000 2.997 3.002 . 0 0 "[ . 1 . 2]" 1
881 1 67 TRP H 1 67 TRP HB2 2.605 2.236 3.036 3.070 3.016 3.119 0.083 19 0 "[ . 1 . 2]" 1
882 1 67 TRP H 1 67 TRP HB3 2.450 2.103 2.855 2.418 2.385 2.446 . 0 0 "[ . 1 . 2]" 1
883 1 67 TRP H 1 67 TRP HE3 4.139 3.552 4.823 4.950 4.892 4.976 0.153 5 0 "[ . 1 . 2]" 1
884 1 67 TRP H 1 67 TRP HE3 4.027 3.361 4.841 4.601 4.562 4.622 . 0 0 "[ . 1 . 2]" 1
885 1 67 TRP H 1 102 VAL H 3.410 2.926 3.974 2.992 2.893 3.099 0.033 3 0 "[ . 1 . 2]" 1
886 1 67 TRP H 1 102 VAL H 3.247 2.787 3.784 3.032 2.924 3.148 . 0 0 "[ . 1 . 2]" 1
887 1 67 TRP H 1 102 VAL HB 3.624 3.110 4.223 3.426 3.277 3.517 . 0 0 "[ . 1 . 2]" 1
888 1 67 TRP H 1 103 GLN HA 3.128 2.684 3.645 3.296 3.211 3.429 . 0 0 "[ . 1 . 2]" 1
889 1 67 TRP HA 1 67 TRP HD1 2.792 2.479 3.406 2.352 2.325 2.377 0.154 4 0 "[ . 1 . 2]" 1
890 1 67 TRP HA 1 67 TRP HE1 4.437 3.808 5.171 4.850 4.817 4.884 . 0 0 "[ . 1 . 2]" 1
891 1 67 TRP HA 1 67 TRP HE3 4.733 3.951 5.689 5.241 5.228 5.253 . 0 0 "[ . 1 . 2]" 1
892 1 67 TRP HA 1 68 ILE H 2.016 . 2.349 2.220 2.210 2.245 . 0 0 "[ . 1 . 2]" 1
893 1 67 TRP HA 1 76 TYR H 4.240 3.639 4.941 4.787 4.689 4.853 . 0 0 "[ . 1 . 2]" 1
894 1 67 TRP HA 1 77 PHE HA 2.693 2.207 3.199 2.994 2.825 3.136 . 0 0 "[ . 1 . 2]" 1
895 1 67 TRP HA 1 77 PHE QD 3.723 3.108 4.475 3.089 3.043 3.166 0.065 13 0 "[ . 1 . 2]" 1
896 1 67 TRP HA 1 78 TYR H 3.660 3.141 4.250 3.910 3.700 4.043 . 0 0 "[ . 1 . 2]" 1
897 1 67 TRP HB2 1 67 TRP HD1 3.950 3.297 4.748 3.405 3.381 3.433 . 0 0 "[ . 1 . 2]" 1
898 1 67 TRP HB2 1 67 TRP HE1 4.320 3.707 5.034 4.511 3.953 4.780 . 0 0 "[ . 1 . 2]" 1
899 1 67 TRP HB2 1 67 TRP HE3 3.417 2.852 4.108 3.290 3.249 3.321 . 0 0 "[ . 1 . 2]" 1
900 1 67 TRP HB2 1 67 TRP HZ3 5.106 4.262 6.138 5.604 5.564 5.635 . 0 0 "[ . 1 . 2]" 1
901 1 67 TRP HB2 1 68 ILE H 3.088 2.650 3.598 3.572 3.488 3.663 0.065 12 0 "[ . 1 . 2]" 1
902 1 67 TRP HB2 1 77 PHE QE 4.093 3.416 4.920 3.373 3.315 3.418 0.101 3 0 "[ . 1 . 2]" 1
903 1 67 TRP HB2 1 103 GLN HA 3.154 2.585 3.848 4.044 4.034 4.061 0.213 4 0 "[ . 1 . 2]" 1
904 1 67 TRP HB2 1 104 SER H 4.677 4.013 5.450 5.393 5.228 5.473 0.023 18 0 "[ . 1 . 2]" 1
905 1 67 TRP HB3 1 67 TRP HD1 4.229 3.530 5.084 3.797 3.788 3.807 . 0 0 "[ . 1 . 2]" 1
906 1 67 TRP HB3 1 67 TRP HE3 2.515 2.061 3.068 2.640 2.625 2.655 . 0 0 "[ . 1 . 2]" 1
907 1 67 TRP HB3 1 77 PHE QD 4.166 3.477 5.008 4.803 4.630 4.910 . 0 0 "[ . 1 . 2]" 1
908 1 67 TRP HB3 1 77 PHE QE 4.375 3.652 5.259 4.851 4.784 4.902 . 0 0 "[ . 1 . 2]" 1
909 1 67 TRP HB3 1 103 GLN HA 2.773 2.273 3.383 2.301 2.295 2.311 . 0 0 "[ . 1 . 2]" 1
910 1 67 TRP HB3 1 104 SER H 3.671 3.150 4.278 3.832 3.667 3.913 . 0 0 "[ . 1 . 2]" 1
911 1 67 TRP HD1 1 68 ILE H . 2.451 2.782 2.427 2.378 2.657 0.073 18 0 "[ . 1 . 2]" 1
912 1 67 TRP HD1 1 68 ILE HA 4.470 3.731 5.373 4.063 3.973 4.182 . 0 0 "[ . 1 . 2]" 1
913 1 67 TRP HD1 1 68 ILE HB 4.501 3.757 5.411 4.558 4.520 4.605 . 0 0 "[ . 1 . 2]" 1
914 1 67 TRP HD1 1 68 ILE MD 4.768 3.980 5.732 5.019 4.979 5.060 . 0 0 "[ . 1 . 2]" 1
915 1 67 TRP HD1 1 68 ILE MD 3.407 2.792 4.157 3.590 3.426 3.785 . 0 0 "[ . 1 . 2]" 1
916 1 67 TRP HD1 1 68 ILE MG 3.692 3.026 4.505 4.303 4.169 4.473 . 0 0 "[ . 1 . 2]" 1
917 1 67 TRP HD1 1 69 LYS HD2 5.199 4.340 6.250 6.161 5.987 6.343 0.093 4 0 "[ . 1 . 2]" 1
918 1 67 TRP HD1 1 70 GLY H 2.952 2.533 3.440 2.864 2.793 2.943 . 0 0 "[ . 1 . 2]" 1
919 1 67 TRP HD1 1 71 ALA H 3.757 3.224 4.378 4.070 4.031 4.105 . 0 0 "[ . 1 . 2]" 1
920 1 67 TRP HD1 1 74 GLY H 3.815 3.274 4.446 3.904 3.815 4.030 . 0 0 "[ . 1 . 2]" 1
921 1 67 TRP HD1 1 74 GLY HA2 3.373 2.764 4.116 4.139 4.102 4.178 0.062 14 0 "[ . 1 . 2]" 1
922 1 67 TRP HD1 1 74 GLY HA3 3.370 2.763 4.112 2.672 2.628 2.713 0.135 15 0 "[ . 1 . 2]" 1
923 1 67 TRP HD1 1 75 ASP H 3.913 3.358 4.560 4.680 4.622 4.718 0.158 14 0 "[ . 1 . 2]" 1
924 1 67 TRP HD1 1 75 ASP HA 3.775 3.151 4.538 4.250 3.941 4.401 . 0 0 "[ . 1 . 2]" 1
925 1 67 TRP HD1 1 75 ASP QB 4.431 3.699 4.680 3.732 3.334 3.881 0.365 6 0 "[ . 1 . 2]" 1
926 1 67 TRP HD1 1 76 TYR H 3.346 2.793 4.022 3.343 3.255 3.401 . 0 0 "[ . 1 . 2]" 1
927 1 67 TRP HD1 1 76 TYR H 2.759 2.368 3.215 3.288 3.204 3.342 0.127 3 0 "[ . 1 . 2]" 1
928 1 67 TRP HD1 1 77 PHE HA 4.100 3.422 4.929 4.128 3.978 4.268 . 0 0 "[ . 1 . 2]" 1
929 1 67 TRP HD1 1 77 PHE QD 3.722 3.376 4.474 3.729 3.624 3.822 . 0 0 "[ . 1 . 2]" 1
930 1 67 TRP HD1 1 77 PHE QE 3.815 3.184 4.586 3.386 3.328 3.453 . 0 0 "[ . 1 . 2]" 1
931 1 67 TRP HD1 1 77 PHE HZ 3.955 3.301 4.754 4.752 4.647 4.793 0.039 4 0 "[ . 1 . 2]" 1
932 1 67 TRP HE1 1 68 ILE H 4.640 3.982 5.407 4.695 4.631 4.954 . 0 0 "[ . 1 . 2]" 1
933 1 67 TRP HE1 1 68 ILE HB 3.592 3.083 4.186 4.266 4.188 4.412 0.226 16 0 "[ . 1 . 2]" 1
934 1 67 TRP HE1 1 68 ILE HG12 4.075 3.497 4.749 3.321 3.277 3.351 0.220 16 0 "[ . 1 . 2]" 1
935 1 67 TRP HE1 1 69 LYS HD2 4.386 3.764 5.111 4.294 4.129 4.543 . 0 0 "[ . 1 . 2]" 1
936 1 67 TRP HE1 1 69 LYS HE2 4.158 3.568 4.845 4.975 4.727 5.681 0.836 17 2 "[ -. 1 . + 2]" 1
937 1 67 TRP HE1 1 69 LYS HG2 4.646 3.987 5.414 5.055 4.970 5.091 . 0 0 "[ . 1 . 2]" 1
938 1 67 TRP HE1 1 75 ASP HA 3.151 2.704 3.555 3.528 3.155 3.652 0.097 18 0 "[ . 1 . 2]" 1
939 1 67 TRP HE1 1 75 ASP QB 3.257 2.795 3.524 2.542 2.394 2.677 0.401 19 0 "[ . 1 . 2]" 1
940 1 67 TRP HE1 1 76 TYR H 3.793 3.626 4.420 4.102 3.897 4.227 . 0 0 "[ . 1 . 2]" 1
941 1 67 TRP HE1 1 77 PHE QE 4.187 3.593 4.879 3.601 3.525 3.682 0.068 14 0 "[ . 1 . 2]" 1
942 1 67 TRP HE3 1 77 PHE QE 4.620 3.856 5.554 4.918 4.786 4.991 . 0 0 "[ . 1 . 2]" 1
943 1 67 TRP HE3 1 101 LEU HB2 3.805 3.176 4.574 3.711 3.568 3.831 . 0 0 "[ . 1 . 2]" 1
944 1 67 TRP HE3 1 101 LEU MD1 4.327 3.612 4.378 3.638 3.565 3.729 0.047 20 0 "[ . 1 . 2]" 1
945 1 67 TRP HE3 1 101 LEU MD2 3.916 3.269 4.707 4.693 4.660 4.730 0.023 10 0 "[ . 1 . 2]" 1
946 1 67 TRP HE3 1 103 GLN HA 3.511 2.878 4.284 3.330 3.239 3.374 . 0 0 "[ . 1 . 2]" 1
947 1 67 TRP HE3 1 103 GLN QB 3.568 2.978 4.289 2.879 2.826 2.953 0.152 4 0 "[ . 1 . 2]" 1
948 1 67 TRP HE3 1 103 GLN QG 4.494 3.751 5.402 4.411 4.033 4.761 . 0 0 "[ . 1 . 2]" 1
949 1 67 TRP HE3 1 104 SER H 4.513 3.767 5.425 5.470 5.333 5.496 0.071 18 0 "[ . 1 . 2]" 1
950 1 67 TRP HH2 1 69 LYS HD2 5.007 4.179 6.019 5.990 5.716 6.080 0.061 14 0 "[ . 1 . 2]" 1
951 1 67 TRP HH2 1 69 LYS HE2 4.936 4.120 5.934 5.910 5.230 6.568 0.634 17 1 "[ . 1 . + 2]" 1
952 1 67 TRP HH2 1 101 LEU MD1 5.365 4.478 6.449 5.083 4.980 5.215 . 0 0 "[ . 1 . 2]" 1
953 1 67 TRP HH2 1 103 GLN QG 4.659 3.889 5.601 5.371 5.154 5.538 . 0 0 "[ . 1 . 2]" 1
954 1 67 TRP HZ2 1 69 LYS HD2 5.155 4.303 6.197 4.247 4.190 4.349 0.113 3 0 "[ . 1 . 2]" 1
955 1 67 TRP HZ2 1 69 LYS HE2 3.957 3.303 4.757 4.133 3.601 4.910 0.153 17 0 "[ . 1 . 2]" 1
956 1 67 TRP HZ2 1 69 LYS HE3 4.831 4.032 5.807 5.100 3.971 5.465 0.061 17 0 "[ . 1 . 2]" 1
957 1 67 TRP HZ2 1 69 LYS HG3 5.527 4.613 6.644 4.779 4.501 4.904 0.112 17 0 "[ . 1 . 2]" 1
958 1 67 TRP HZ2 1 69 LYS QZ 2.458 2.052 2.955 2.520 1.986 3.006 0.066 17 0 "[ . 1 . 2]" 1
959 1 67 TRP HZ2 1 75 ASP HA 5.395 4.503 6.485 5.878 5.429 6.033 . 0 0 "[ . 1 . 2]" 1
960 1 67 TRP HZ2 1 77 PHE QE 4.553 3.800 5.473 4.723 4.589 4.796 . 0 0 "[ . 1 . 2]" 1
961 1 67 TRP HZ2 1 77 PHE HZ 4.557 3.804 5.478 5.427 5.309 5.513 0.035 6 0 "[ . 1 . 2]" 1
962 1 67 TRP HZ3 1 101 LEU MD1 4.143 3.509 4.980 4.265 4.192 4.356 . 0 0 "[ . 1 . 2]" 1
963 1 67 TRP HZ3 1 101 LEU MD2 5.057 4.221 6.079 6.137 6.116 6.170 0.091 20 0 "[ . 1 . 2]" 1
964 1 67 TRP HZ3 1 103 GLN QB 4.233 3.533 5.089 3.409 3.353 3.456 0.180 18 0 "[ . 1 . 2]" 1
965 1 67 TRP HZ3 1 103 GLN QG 4.625 3.860 5.560 4.666 4.454 4.880 . 0 0 "[ . 1 . 2]" 1
966 1 68 ILE H 1 68 ILE HA 2.838 2.469 3.307 2.999 2.995 3.003 . 0 0 "[ . 1 . 2]" 1
967 1 68 ILE H 1 68 ILE HB 2.642 2.267 3.079 2.786 2.654 2.824 . 0 0 "[ . 1 . 2]" 1
968 1 68 ILE H 1 68 ILE MD 3.864 3.167 4.714 4.125 3.814 4.183 . 0 0 "[ . 1 . 2]" 1
969 1 68 ILE H 1 68 ILE MD 3.093 2.654 3.604 3.583 3.424 3.610 0.006 5 0 "[ . 1 . 2]" 1
970 1 68 ILE H 1 68 ILE HG12 3.212 2.756 3.743 3.754 3.713 4.002 0.259 12 0 "[ . 1 . 2]" 1
971 1 68 ILE H 1 68 ILE HG13 3.244 2.784 3.780 2.768 2.741 2.806 0.043 17 0 "[ . 1 . 2]" 1
972 1 68 ILE H 1 68 ILE MG 3.503 2.871 4.274 3.935 3.874 3.946 . 0 0 "[ . 1 . 2]" 1
973 1 68 ILE H 1 69 LYS H 4.320 3.707 5.034 4.425 4.393 4.456 . 0 0 "[ . 1 . 2]" 1
974 1 68 ILE H 1 76 TYR H 3.596 3.086 4.190 3.413 3.242 3.635 . 0 0 "[ . 1 . 2]" 1
975 1 68 ILE H 1 76 TYR H 3.513 3.015 4.094 3.352 3.197 3.527 . 0 0 "[ . 1 . 2]" 1
976 1 68 ILE H 1 76 TYR QD 4.893 4.084 5.882 5.139 4.967 5.264 . 0 0 "[ . 1 . 2]" 1
977 1 68 ILE H 1 77 PHE QD 4.296 3.586 5.164 4.691 4.610 4.755 . 0 0 "[ . 1 . 2]" 1
978 1 68 ILE H 1 104 SER H 4.926 4.227 5.740 4.222 4.161 4.263 0.066 12 0 "[ . 1 . 2]" 1
979 1 68 ILE HA 1 68 ILE HB 3.059 2.507 3.732 3.030 3.026 3.032 . 0 0 "[ . 1 . 2]" 1
980 1 68 ILE HA 1 68 ILE MD 3.804 3.118 4.641 3.767 3.747 3.850 . 0 0 "[ . 1 . 2]" 1
981 1 68 ILE HA 1 68 ILE MD 2.412 . 2.943 2.316 2.273 2.333 . 0 0 "[ . 1 . 2]" 1
982 1 68 ILE HA 1 68 ILE HG12 2.958 2.424 3.609 2.515 2.478 2.623 . 0 0 "[ . 1 . 2]" 1
983 1 68 ILE HA 1 68 ILE HG13 3.198 2.621 3.902 3.211 2.953 3.244 . 0 0 "[ . 1 . 2]" 1
984 1 68 ILE HA 1 68 ILE MG 2.709 2.220 3.305 2.337 2.290 2.356 . 0 0 "[ . 1 . 2]" 1
985 1 68 ILE HA 1 69 LYS H 2.110 . 2.459 2.224 2.201 2.245 . 0 0 "[ . 1 . 2]" 1
986 1 68 ILE HA 1 70 GLY H 4.001 3.433 4.662 4.666 4.601 4.718 0.056 13 0 "[ . 1 . 2]" 1
987 1 68 ILE HA 1 104 SER H 3.824 3.282 3.963 3.273 3.217 3.341 0.065 18 0 "[ . 1 . 2]" 1
988 1 68 ILE HB 1 76 TYR H 3.559 3.054 4.147 4.197 4.099 4.264 0.117 12 0 "[ . 1 . 2]" 1
989 1 68 ILE HB 1 76 TYR QD 3.780 3.155 4.544 4.231 4.179 4.274 . 0 0 "[ . 1 . 2]" 1
990 1 68 ILE HB 1 78 TYR QE 3.807 3.178 4.576 4.006 3.599 4.378 . 0 0 "[ . 1 . 2]" 1
991 1 68 ILE HB 1 109 LEU MD1 3.621 2.968 4.419 4.457 4.432 4.492 0.073 11 0 "[ . 1 . 2]" 1
992 1 68 ILE MD 1 69 LYS HA 3.231 2.649 3.942 3.908 3.800 3.947 0.005 6 0 "[ . 1 . 2]" 1
993 1 68 ILE MD 1 70 GLY H 4.322 3.709 5.036 4.830 4.651 4.883 . 0 0 "[ . 1 . 2]" 1
994 1 68 ILE MD 1 104 SER HA 3.986 3.267 4.863 4.384 4.287 4.505 . 0 0 "[ . 1 . 2]" 1
995 1 68 ILE MD 1 104 SER HB2 2.707 2.219 3.303 2.702 2.642 2.830 . 0 0 "[ . 1 . 2]" 1
996 1 68 ILE MD 1 104 SER HB3 2.833 2.322 3.457 2.914 2.760 3.060 . 0 0 "[ . 1 . 2]" 1
997 1 68 ILE MD 1 105 THR H 3.925 3.368 4.574 3.480 3.378 3.578 . 0 0 "[ . 1 . 2]" 1
998 1 68 ILE MD 1 105 THR HA 2.772 2.272 3.382 2.637 2.502 2.848 . 0 0 "[ . 1 . 2]" 1
999 1 68 ILE MD 1 106 LEU H 3.613 3.101 4.210 3.118 3.044 3.367 0.057 9 0 "[ . 1 . 2]" 1
1000 1 68 ILE MD 1 106 LEU HA 2.931 2.402 3.576 2.633 2.460 2.932 . 0 0 "[ . 1 . 2]" 1
1001 1 68 ILE MD 1 106 LEU MD1 3.279 2.687 4.001 3.645 2.663 4.187 0.186 18 0 "[ . 1 . 2]" 1
1002 1 68 ILE MD 1 106 LEU MD2 3.530 2.893 4.307 3.762 2.608 4.441 0.285 10 0 "[ . 1 . 2]" 1
1003 1 68 ILE MD 1 109 LEU H 3.744 3.213 4.363 3.190 3.127 3.305 0.086 16 0 "[ . 1 . 2]" 1
1004 1 68 ILE MD 1 109 LEU MD1 2.814 2.306 3.433 2.213 2.176 2.264 0.130 5 0 "[ . 1 . 2]" 1
1005 1 68 ILE MD 1 109 LEU MD2 2.803 2.297 3.420 2.219 2.176 2.268 0.121 14 0 "[ . 1 . 2]" 1
1006 1 68 ILE MD 1 104 SER HB2 3.302 2.706 4.029 2.737 2.672 2.879 0.034 15 0 "[ . 1 . 2]" 1
1007 1 68 ILE MD 1 104 SER HB3 3.546 2.906 4.327 2.955 2.790 3.120 0.116 12 0 "[ . 1 . 2]" 1
1008 1 68 ILE MD 1 105 THR HA 3.999 3.278 4.879 3.635 3.283 3.983 . 0 0 "[ . 1 . 2]" 1
1009 1 68 ILE MD 1 109 LEU HB3 3.084 2.528 3.763 3.640 3.431 3.845 0.082 2 0 "[ . 1 . 2]" 1
1010 1 68 ILE MD 1 109 LEU QD 2.475 2.029 3.020 2.056 2.034 2.102 . 0 0 "[ . 1 . 2]" 1
1011 1 68 ILE MD 1 120 LEU MD2 4.500 4.000 1003.500 5.038 4.634 5.435 . 0 0 "[ . 1 . 2]" 1
1012 1 68 ILE HG12 1 69 LYS H 3.198 2.744 3.727 3.722 3.680 3.745 0.018 17 0 "[ . 1 . 2]" 1
1013 1 68 ILE HG12 1 76 TYR QD 4.336 3.619 5.212 4.718 4.605 4.885 . 0 0 "[ . 1 . 2]" 1
1014 1 68 ILE HG12 1 76 TYR QE 3.782 3.157 4.546 4.573 4.511 4.611 0.065 6 0 "[ . 1 . 2]" 1
1015 1 68 ILE HG12 1 104 SER HB3 3.089 2.532 3.380 3.344 2.848 3.408 0.028 18 0 "[ . 1 . 2]" 1
1016 1 68 ILE HG13 1 69 LYS H 4.755 4.081 5.541 5.121 4.944 5.157 . 0 0 "[ . 1 . 2]" 1
1017 1 68 ILE MG 1 69 LYS H 2.591 2.224 3.019 2.236 2.183 2.326 0.041 13 0 "[ . 1 . 2]" 1
1018 1 68 ILE MG 1 76 TYR QB 3.543 2.904 4.323 4.402 4.303 4.447 0.124 20 0 "[ . 1 . 2]" 1
1019 1 68 ILE MG 1 104 SER H 4.576 3.927 5.332 4.052 3.918 4.296 0.009 10 0 "[ . 1 . 2]" 1
1020 1 68 ILE MG 1 104 SER HB2 4.709 3.860 5.745 4.169 4.124 4.243 . 0 0 "[ . 1 . 2]" 1
1021 1 68 ILE MG 1 104 SER HB3 3.572 2.928 4.358 4.448 4.395 4.493 0.135 5 0 "[ . 1 . 2]" 1
1022 1 68 ILE MG 1 105 THR HA 3.219 2.638 3.928 2.709 2.591 2.934 0.047 18 0 "[ . 1 . 2]" 1
1023 1 68 ILE MG 1 105 THR MG 3.982 3.264 4.858 4.175 3.927 4.409 . 0 0 "[ . 1 . 2]" 1
1024 1 68 ILE MG 1 109 LEU QD 2.556 2.095 3.119 2.552 2.413 2.683 . 0 0 "[ . 1 . 2]" 1
1025 1 68 ILE MG 1 120 LEU MD2 4.500 4.000 1003.500 4.591 4.253 4.870 . 0 0 "[ . 1 . 2]" 1
1026 1 69 LYS H 1 69 LYS HA 3.151 2.704 3.672 2.981 2.974 2.985 . 0 0 "[ . 1 . 2]" 1
1027 1 69 LYS H 1 69 LYS QB 2.355 2.021 2.744 2.221 2.186 2.232 . 0 0 "[ . 1 . 2]" 1
1028 1 69 LYS H 1 69 LYS HD2 3.835 3.291 4.469 4.487 4.433 4.517 0.048 3 0 "[ . 1 . 2]" 1
1029 1 69 LYS H 1 69 LYS HG2 3.887 3.336 4.530 4.653 4.617 4.667 0.137 13 0 "[ . 1 . 2]" 1
1030 1 69 LYS H 1 70 GLY H 4.444 4.329 5.179 4.575 4.562 4.589 . 0 0 "[ . 1 . 2]" 1
1031 1 69 LYS HA 1 70 GLY H 2.075 . 2.418 2.346 2.331 2.357 . 0 0 "[ . 1 . 2]" 1
1032 1 69 LYS HA 1 75 ASP HA 2.533 2.149 3.091 2.396 2.344 2.496 . 0 0 "[ . 1 . 2]" 1
1033 1 69 LYS HA 1 76 TYR H 3.307 2.838 3.854 3.121 3.053 3.230 . 0 0 "[ . 1 . 2]" 1
1034 1 69 LYS HA 1 76 TYR QD 3.606 3.010 4.335 2.983 2.950 3.046 0.060 12 0 "[ . 1 . 2]" 1
1035 1 69 LYS HA 1 76 TYR QE 4.071 3.398 4.894 4.262 4.155 4.343 . 0 0 "[ . 1 . 2]" 1
1036 1 69 LYS HA 1 109 LEU MD2 4.045 3.315 4.935 4.420 4.257 4.665 . 0 0 "[ . 1 . 2]" 1
1037 1 69 LYS HA 1 120 LEU MD1 3.977 3.259 4.852 4.448 4.277 4.701 . 0 0 "[ . 1 . 2]" 1
1038 1 69 LYS HA 1 120 LEU MD2 4.388 3.652 5.354 5.491 5.440 5.527 0.173 16 0 "[ . 1 . 2]" 1
1039 1 69 LYS QB 1 70 GLY H 2.691 2.309 3.136 3.015 2.982 3.082 . 0 0 "[ . 1 . 2]" 1
1040 1 69 LYS HD3 1 70 GLY H 4.122 3.537 4.803 4.875 4.838 4.911 0.108 10 0 "[ . 1 . 2]" 1
1041 1 69 LYS HE2 1 73 GLY HA2 3.856 3.160 4.705 4.059 2.935 4.525 0.225 17 0 "[ . 1 . 2]" 1
1042 1 69 LYS HE3 1 73 GLY HA2 3.827 3.137 4.669 2.937 2.405 3.478 0.732 6 5 "[* - .+ 1** . 2]" 1
1043 1 69 LYS HG3 1 70 GLY H 4.338 3.723 5.055 3.652 3.604 3.686 0.119 17 0 "[ . 1 . 2]" 1
1044 1 70 GLY H 1 70 GLY HA2 2.483 2.035 3.030 2.967 2.954 2.983 . 0 0 "[ . 1 . 2]" 1
1045 1 70 GLY H 1 70 GLY HA2 2.609 2.239 3.040 2.837 2.812 2.865 . 0 0 "[ . 1 . 2]" 1
1046 1 70 GLY H 1 70 GLY HA3 2.463 2.114 2.870 2.405 2.392 2.434 . 0 0 "[ . 1 . 2]" 1
1047 1 70 GLY H 1 71 ALA H 3.825 3.283 4.457 4.446 4.374 4.485 0.028 20 0 "[ . 1 . 2]" 1
1048 1 70 GLY H 1 71 ALA H 3.075 2.639 3.583 2.689 2.667 2.717 . 0 0 "[ . 1 . 2]" 1
1049 1 70 GLY H 1 74 GLY H 3.352 2.877 3.906 2.841 2.822 2.858 0.055 3 0 "[ . 1 . 2]" 1
1050 1 70 GLY H 1 74 GLY H 4.038 3.466 4.705 3.448 3.388 3.519 0.078 14 0 "[ . 1 . 2]" 1
1051 1 70 GLY H 1 75 ASP HA 3.637 3.121 4.238 3.819 3.738 3.959 . 0 0 "[ . 1 . 2]" 1
1052 1 70 GLY H 1 76 TYR H 4.665 4.003 5.436 4.803 4.734 4.862 . 0 0 "[ . 1 . 2]" 1
1053 1 70 GLY H 1 76 TYR QD 3.136 2.854 3.654 3.133 3.059 3.234 . 0 0 "[ . 1 . 2]" 1
1054 1 70 GLY H 1 76 TYR QE 3.262 2.723 3.921 2.865 2.795 2.946 . 0 0 "[ . 1 . 2]" 1
1055 1 70 GLY H 1 109 LEU MD2 3.911 3.205 4.772 4.454 4.287 4.724 . 0 0 "[ . 1 . 2]" 1
1056 1 70 GLY H 1 120 LEU HB3 4.590 3.939 5.349 3.996 3.922 4.103 0.017 1 0 "[ . 1 . 2]" 1
1057 1 70 GLY H 1 120 LEU MD1 4.748 4.075 5.533 4.474 4.301 4.752 . 0 0 "[ . 1 . 2]" 1
1058 1 70 GLY HA2 1 71 ALA H 2.384 2.056 2.778 2.669 2.596 2.753 . 0 0 "[ . 1 . 2]" 1
1059 1 70 GLY HA2 1 72 GLN H 3.744 3.213 4.363 4.177 4.113 4.261 . 0 0 "[ . 1 . 2]" 1
1060 1 70 GLY HA2 1 76 TYR QD 3.887 3.245 4.673 3.695 3.662 3.765 . 0 0 "[ . 1 . 2]" 1
1061 1 70 GLY HA2 1 76 TYR QE 2.995 2.500 3.600 2.596 2.562 2.630 . 0 0 "[ . 1 . 2]" 1
1062 1 70 GLY HA3 1 71 ALA H 2.547 2.238 2.968 2.475 2.409 2.530 . 0 0 "[ . 1 . 2]" 1
1063 1 70 GLY HA3 1 71 ALA MB 3.709 3.040 4.525 4.232 4.195 4.274 . 0 0 "[ . 1 . 2]" 1
1064 1 70 GLY HA3 1 72 GLN H 3.494 2.999 4.072 3.093 3.060 3.159 . 0 0 "[ . 1 . 2]" 1
1065 1 70 GLY HA3 1 76 TYR QD 3.863 3.224 4.644 3.771 3.695 3.844 . 0 0 "[ . 1 . 2]" 1
1066 1 70 GLY HA3 1 76 TYR QE 3.033 2.532 3.646 2.478 2.422 2.520 0.110 17 0 "[ . 1 . 2]" 1
1067 1 70 GLY HA3 1 121 GLN HA 3.335 2.733 4.069 3.496 3.303 3.627 . 0 0 "[ . 1 . 2]" 1
1068 1 71 ALA H 1 71 ALA HA 2.492 2.332 2.904 2.877 2.865 2.889 . 0 0 "[ . 1 . 2]" 1
1069 1 71 ALA H 1 71 ALA MB 2.092 . 2.438 2.192 2.161 2.218 . 0 0 "[ . 1 . 2]" 1
1070 1 71 ALA H 1 72 GLN H 3.294 2.827 3.838 2.712 2.689 2.740 0.138 1 0 "[ . 1 . 2]" 1
1071 1 71 ALA H 1 73 GLY H 4.683 4.019 4.828 4.709 4.518 4.853 0.025 11 0 "[ . 1 . 2]" 1
1072 1 71 ALA H 1 121 GLN H 4.143 3.555 4.828 4.070 3.962 4.180 . 0 0 "[ . 1 . 2]" 1
1073 1 71 ALA H 1 121 GLN HA 2.737 2.243 2.771 2.301 2.167 2.518 0.076 7 0 "[ . 1 . 2]" 1
1074 1 71 ALA H 1 121 GLN HB2 5.000 4.500 1004.000 5.184 5.090 5.394 . 0 0 "[ . 1 . 2]" 1
1075 1 71 ALA H 1 121 GLN HB3 4.175 3.583 4.865 4.647 4.495 4.866 0.001 2 0 "[ . 1 . 2]" 1
1076 1 71 ALA H 1 121 GLN HE21 5.000 4.500 1004.000 4.840 4.747 4.963 . 0 0 "[ . 1 . 2]" 1
1077 1 71 ALA H 1 121 GLN HE22 5.000 4.500 1004.000 4.428 4.381 4.474 0.119 7 0 "[ . 1 . 2]" 1
1078 1 71 ALA H 1 121 GLN HG2 5.000 4.500 1004.000 5.136 5.058 5.250 . 0 0 "[ . 1 . 2]" 1
1079 1 71 ALA H 1 121 GLN HG3 5.000 4.500 1004.000 5.904 5.777 6.077 . 0 0 "[ . 1 . 2]" 1
1080 1 71 ALA HA 1 72 GLN H 3.419 2.934 3.984 3.381 3.366 3.396 . 0 0 "[ . 1 . 2]" 1
1081 1 71 ALA HA 1 73 GLY H 3.739 3.209 4.357 4.082 3.975 4.167 . 0 0 "[ . 1 . 2]" 1
1082 1 71 ALA HA 1 76 TYR QE 3.800 3.172 4.568 4.029 3.896 4.142 . 0 0 "[ . 1 . 2]" 1
1083 1 71 ALA MB 1 72 GLN H . 3.171 3.434 3.205 3.180 3.226 . 0 0 "[ . 1 . 2]" 1
1084 1 71 ALA MB 1 72 GLN HA 3.705 3.037 4.520 4.183 4.158 4.202 . 0 0 "[ . 1 . 2]" 1
1085 1 71 ALA MB 1 72 GLN HE21 4.135 3.549 4.744 3.768 3.712 3.816 . 0 0 "[ . 1 . 2]" 1
1086 1 71 ALA MB 1 72 GLN HE22 4.756 4.082 5.072 5.167 5.146 5.205 0.133 16 0 "[ . 1 . 2]" 1
1087 1 71 ALA MB 1 72 GLN HG2 3.576 2.931 4.363 3.158 2.980 3.540 . 0 0 "[ . 1 . 2]" 1
1088 1 71 ALA MB 1 72 GLN HG3 3.579 2.933 4.367 2.886 2.836 2.967 0.097 3 0 "[ . 1 . 2]" 1
1089 1 71 ALA MB 1 121 GLN HA 2.653 2.351 3.237 2.434 2.312 2.623 0.039 12 0 "[ . 1 . 2]" 1
1090 1 71 ALA MB 1 121 GLN HE21 3.786 3.364 4.412 4.521 4.501 4.546 0.134 8 0 "[ . 1 . 2]" 1
1091 1 71 ALA MB 1 121 GLN HE22 3.512 3.014 4.010 3.596 3.537 3.667 . 0 0 "[ . 1 . 2]" 1
1092 1 72 GLN H 1 72 GLN HA 3.084 2.647 3.594 3.005 3.000 3.009 . 0 0 "[ . 1 . 2]" 1
1093 1 72 GLN H 1 72 GLN HB2 2.843 2.440 3.313 2.819 2.765 2.869 . 0 0 "[ . 1 . 2]" 1
1094 1 72 GLN H 1 72 GLN HB3 2.757 2.366 3.213 2.662 2.625 2.701 . 0 0 "[ . 1 . 2]" 1
1095 1 72 GLN H 1 72 GLN HG2 3.226 2.769 3.759 3.445 3.304 3.764 0.005 3 0 "[ . 1 . 2]" 1
1096 1 72 GLN H 1 73 GLY H 2.846 2.442 3.308 2.567 2.416 2.711 0.026 20 0 "[ . 1 . 2]" 1
1097 1 72 GLN H 1 74 GLY H 3.588 3.079 4.181 3.025 2.999 3.050 0.080 3 0 "[ . 1 . 2]" 1
1098 1 72 GLN H 1 121 GLN H 5.000 4.500 1004.000 4.916 4.838 5.067 . 0 0 "[ . 1 . 2]" 1
1099 1 72 GLN H 1 121 GLN HA 3.004 2.462 3.099 3.111 3.049 3.156 0.057 1 0 "[ . 1 . 2]" 1
1100 1 72 GLN H 1 121 GLN HB3 4.084 3.505 4.759 4.615 4.461 4.768 0.009 2 0 "[ . 1 . 2]" 1
1101 1 72 GLN HA 1 73 GLY H 3.157 2.709 3.679 2.947 2.862 3.051 . 0 0 "[ . 1 . 2]" 1
1102 1 72 GLN HA 1 74 GLY H 4.885 4.192 5.692 4.182 4.085 4.294 0.107 6 0 "[ . 1 . 2]" 1
1103 1 72 GLN HB2 1 72 GLN HE21 4.131 3.545 4.814 4.514 4.358 4.579 . 0 0 "[ . 1 . 2]" 1
1104 1 72 GLN HB2 1 72 GLN HE22 4.566 3.919 5.321 4.792 4.611 4.860 . 0 0 "[ . 1 . 2]" 1
1105 1 72 GLN HB2 1 73 GLY H 4.061 3.485 4.732 4.108 3.991 4.202 . 0 0 "[ . 1 . 2]" 1
1106 1 72 GLN HB3 1 72 GLN HE21 2.962 2.542 3.451 2.686 2.532 2.759 0.010 3 0 "[ . 1 . 2]" 1
1107 1 72 GLN HB3 1 72 GLN HE22 3.316 2.846 3.864 3.527 3.489 3.545 . 0 0 "[ . 1 . 2]" 1
1108 1 72 GLN HB3 1 73 GLY H 3.976 3.412 4.633 4.179 4.151 4.218 . 0 0 "[ . 1 . 2]" 1
1109 1 72 GLN HB3 1 74 GLY H 4.616 3.961 5.379 3.914 3.862 3.971 0.099 16 0 "[ . 1 . 2]" 1
1110 1 72 GLN HE21 1 72 GLN HG2 3.296 2.829 3.841 2.608 2.529 2.778 0.300 14 0 "[ . 1 . 2]" 1
1111 1 72 GLN HE21 1 121 GLN HA 4.508 3.869 5.253 4.345 4.037 4.540 . 0 0 "[ . 1 . 2]" 1
1112 1 72 GLN HE21 1 121 GLN HB2 4.221 3.622 4.919 4.745 4.587 4.914 . 0 0 "[ . 1 . 2]" 1
1113 1 72 GLN HE21 1 121 GLN HB3 3.515 3.016 4.096 3.105 2.960 3.311 0.056 18 0 "[ . 1 . 2]" 1
1114 1 72 GLN HE21 1 121 GLN HE21 5.000 4.500 1004.000 6.774 6.491 7.176 . 0 0 "[ . 1 . 2]" 1
1115 1 72 GLN HE21 1 121 GLN HE22 5.000 4.500 1004.000 6.278 5.927 6.709 . 0 0 "[ . 1 . 2]" 1
1116 1 72 GLN HE22 1 72 GLN HG2 3.706 3.180 4.319 3.652 3.618 3.726 . 0 0 "[ . 1 . 2]" 1
1117 1 72 GLN HE22 1 121 GLN HB2 4.460 3.827 5.197 4.895 4.558 5.103 . 0 0 "[ . 1 . 2]" 1
1118 1 72 GLN HE22 1 121 GLN HB3 3.673 3.152 4.281 3.619 3.184 3.903 . 0 0 "[ . 1 . 2]" 1
1119 1 72 GLN HG2 1 73 GLY H 4.774 4.097 5.563 4.902 4.847 5.059 . 0 0 "[ . 1 . 2]" 1
1120 1 73 GLY H 1 73 GLY HA2 2.341 2.075 2.728 2.345 2.334 2.361 . 0 0 "[ . 1 . 2]" 1
1121 1 73 GLY H 1 73 GLY HA3 2.517 2.160 2.933 2.886 2.851 2.925 . 0 0 "[ . 1 . 2]" 1
1122 1 73 GLY H 1 74 GLY H 2.845 2.442 3.311 2.879 2.776 2.952 . 0 0 "[ . 1 . 2]" 1
1123 1 73 GLY HA2 1 74 GLY H 3.255 2.793 3.793 3.409 3.391 3.433 . 0 0 "[ . 1 . 2]" 1
1124 1 73 GLY HA3 1 74 GLY H 3.564 3.059 4.101 3.199 3.176 3.225 . 0 0 "[ . 1 . 2]" 1
1125 1 74 GLY H 1 74 GLY HA2 2.813 2.306 3.432 2.794 2.784 2.807 . 0 0 "[ . 1 . 2]" 1
1126 1 74 GLY H 1 74 GLY QA 2.351 2.018 2.740 2.227 2.218 2.232 . 0 0 "[ . 1 . 2]" 1
1127 1 74 GLY H 1 74 GLY HA3 2.859 2.343 3.488 2.340 2.330 2.347 0.013 6 0 "[ . 1 . 2]" 1
1128 1 74 GLY H 1 75 ASP H 3.596 3.322 4.190 4.375 4.326 4.455 0.265 16 0 "[ . 1 . 2]" 1
1129 1 74 GLY H 1 76 TYR QD 4.697 4.031 5.473 5.528 5.458 5.594 0.121 17 0 "[ . 1 . 2]" 1
1130 1 74 GLY H 1 76 TYR QE 4.136 3.452 4.972 3.907 3.817 4.034 . 0 0 "[ . 1 . 2]" 1
1131 1 74 GLY QA 1 75 ASP H 2.197 . 2.560 2.143 2.132 2.154 . 0 0 "[ . 1 . 2]" 1
1132 1 74 GLY QA 1 76 TYR H 4.481 3.846 5.222 5.335 5.256 5.376 0.154 10 0 "[ . 1 . 2]" 1
1133 1 74 GLY HA2 1 75 ASP H 2.672 2.190 3.260 2.169 2.159 2.179 0.031 16 0 "[ . 1 . 2]" 1
1134 1 74 GLY HA3 1 75 ASP H 2.718 2.228 3.316 3.352 3.293 3.380 0.064 8 0 "[ . 1 . 2]" 1
1135 1 75 ASP H 1 75 ASP HA 3.091 2.653 3.541 2.905 2.897 2.922 . 0 0 "[ . 1 . 2]" 1
1136 1 75 ASP H 1 75 ASP QB 2.553 2.508 2.975 2.756 2.232 2.918 0.276 4 0 "[ . 1 . 2]" 1
1137 1 75 ASP H 1 76 TYR H 4.480 3.845 5.221 4.594 4.564 4.610 . 0 0 "[ . 1 . 2]" 1
1138 1 75 ASP H 1 76 TYR QD 4.539 3.789 5.456 4.884 4.782 4.923 . 0 0 "[ . 1 . 2]" 1
1139 1 75 ASP H 1 76 TYR QE 3.989 3.330 4.795 4.768 4.730 4.809 0.014 14 0 "[ . 1 . 2]" 1
1140 1 75 ASP HA 1 76 TYR H 2.106 . 2.454 2.215 2.205 2.224 . 0 0 "[ . 1 . 2]" 1
1141 1 75 ASP HA 1 76 TYR QD 3.614 3.017 4.344 3.511 3.324 3.585 . 0 0 "[ . 1 . 2]" 1
1142 1 75 ASP HA 1 76 TYR QE 4.421 3.690 5.315 4.665 4.586 4.700 . 0 0 "[ . 1 . 2]" 1
1143 1 75 ASP QB 1 76 TYR H 3.679 3.157 4.014 3.140 3.031 3.214 0.126 13 0 "[ . 1 . 2]" 1
1144 1 75 ASP QB 1 77 PHE QE 3.837 3.203 4.493 3.099 2.988 3.252 0.215 3 0 "[ . 1 . 2]" 1
1145 1 75 ASP QB 1 77 PHE QE 2.871 2.353 3.476 2.724 2.646 2.824 . 0 0 "[ . 1 . 2]" 1
1146 1 75 ASP QB 1 77 PHE HZ 4.103 3.425 4.457 3.025 2.911 3.198 0.514 6 2 "[- .+ 1 . 2]" 1
1147 1 76 TYR H 1 76 TYR HA 2.920 2.506 3.403 3.004 3.000 3.010 . 0 0 "[ . 1 . 2]" 1
1148 1 76 TYR H 1 76 TYR QB 2.596 2.228 3.025 2.620 2.562 2.658 . 0 0 "[ . 1 . 2]" 1
1149 1 76 TYR H 1 76 TYR QD 2.547 2.520 2.968 2.917 2.614 2.991 0.023 12 0 "[ . 1 . 2]" 1
1150 1 76 TYR H 1 77 PHE H 4.057 3.497 4.728 4.330 4.224 4.477 . 0 0 "[ . 1 . 2]" 1
1151 1 76 TYR HA 1 76 TYR QD 2.916 2.615 3.558 2.794 2.723 2.967 . 0 0 "[ . 1 . 2]" 1
1152 1 76 TYR HA 1 77 PHE H 2.053 . 2.392 2.214 2.182 2.312 . 0 0 "[ . 1 . 2]" 1
1153 1 76 TYR QB 1 77 PHE H 2.328 . 2.713 3.042 2.741 3.154 0.441 14 0 "[ . 1 . 2]" 1
1154 1 76 TYR QB 1 78 TYR QD 3.003 2.507 3.610 3.377 3.191 3.550 . 0 0 "[ . 1 . 2]" 1
1155 1 76 TYR QD 1 77 PHE H 3.783 3.158 4.548 4.176 3.906 4.434 . 0 0 "[ . 1 . 2]" 1
1156 1 76 TYR QD 1 109 LEU MD2 3.290 2.700 4.010 2.824 2.643 3.103 0.057 12 0 "[ . 1 . 2]" 1
1157 1 76 TYR QD 1 109 LEU MD2 3.307 2.760 3.975 3.008 2.742 3.473 0.018 12 0 "[ . 1 . 2]" 1
1158 1 76 TYR QD 1 119 ASP H 3.571 3.065 4.161 4.188 3.934 4.410 0.249 2 0 "[ . 1 . 2]" 1
1159 1 76 TYR QD 1 119 ASP HB3 3.382 2.772 4.126 4.209 4.022 4.337 0.211 20 0 "[ . 1 . 2]" 1
1160 1 76 TYR QD 1 120 LEU MD2 3.501 2.869 4.272 2.792 2.731 2.853 0.138 10 0 "[ . 1 . 2]" 1
1161 1 76 TYR QD 1 121 GLN H 3.789 3.252 4.415 4.248 4.200 4.283 . 0 0 "[ . 1 . 2]" 1
1162 1 76 TYR QD 1 120 LEU MD2 3.419 2.868 4.092 2.969 2.884 3.064 . 0 0 "[ . 1 . 2]" 1
1163 1 76 TYR QE 1 109 LEU MD2 3.217 2.637 3.925 2.790 2.580 3.106 0.057 15 0 "[ . 1 . 2]" 1
1164 1 76 TYR QE 1 120 LEU MD2 3.386 2.775 4.131 2.667 2.588 2.744 0.187 13 0 "[ . 1 . 2]" 1
1165 1 76 TYR QE 1 121 GLN H 3.636 3.120 4.237 3.064 3.001 3.122 0.119 8 0 "[ . 1 . 2]" 1
1166 1 76 TYR QE 1 120 LEU MD2 3.186 2.659 3.830 3.242 3.042 3.492 . 0 0 "[ . 1 . 2]" 1
1167 1 77 PHE H 1 77 PHE HA 2.982 2.559 3.475 2.987 2.973 3.008 . 0 0 "[ . 1 . 2]" 1
1168 1 77 PHE H 1 77 PHE HB2 2.970 2.549 3.461 2.577 2.543 2.712 0.006 3 0 "[ . 1 . 2]" 1
1169 1 77 PHE H 1 77 PHE QD 3.069 2.837 3.576 2.726 2.677 2.845 0.160 16 0 "[ . 1 . 2]" 1
1170 1 77 PHE H 1 78 TYR H 4.486 3.850 4.788 4.351 4.285 4.429 . 0 0 "[ . 1 . 2]" 1
1171 1 77 PHE HA 1 77 PHE QD 3.327 2.769 3.987 2.671 2.645 2.736 0.124 13 0 "[ . 1 . 2]" 1
1172 1 77 PHE HA 1 78 TYR H 2.088 . 2.433 2.154 2.136 2.166 . 0 0 "[ . 1 . 2]" 1
1173 1 77 PHE HA 1 78 TYR QD 3.936 3.285 4.731 3.817 3.624 4.243 . 0 0 "[ . 1 . 2]" 1
1174 1 77 PHE HB2 1 78 TYR H 2.679 2.299 3.122 3.414 3.383 3.434 0.312 17 0 "[ . 1 . 2]" 1
1175 1 77 PHE HB3 1 78 TYR H 2.530 2.171 2.948 2.298 2.251 2.343 . 0 0 "[ . 1 . 2]" 1
1176 1 77 PHE QD 1 78 TYR H 3.614 3.547 4.211 4.284 4.234 4.342 0.131 14 0 "[ . 1 . 2]" 1
1177 1 77 PHE QD 1 101 LEU MD1 3.921 3.273 4.713 4.013 3.888 4.106 . 0 0 "[ . 1 . 2]" 1
1178 1 77 PHE QD 1 101 LEU MD2 3.239 2.704 3.893 2.783 2.691 2.892 0.013 5 0 "[ . 1 . 2]" 1
1179 1 77 PHE QE 1 101 LEU MD1 3.512 2.931 4.222 2.877 2.835 2.926 0.096 19 0 "[ . 1 . 2]" 1
1180 1 77 PHE QE 1 101 LEU MD2 3.434 2.866 4.128 3.180 3.047 3.381 . 0 0 "[ . 1 . 2]" 1
1181 1 77 PHE HZ 1 101 LEU MD1 4.403 3.675 5.293 4.248 4.155 4.381 . 0 0 "[ . 1 . 2]" 1
1182 1 77 PHE HZ 1 101 LEU MD2 4.516 3.770 5.429 4.867 4.671 5.046 . 0 0 "[ . 1 . 2]" 1
1183 1 78 TYR H 1 78 TYR HA 3.208 2.753 3.447 2.991 2.970 3.001 . 0 0 "[ . 1 . 2]" 1
1184 1 78 TYR H 1 78 TYR QD 2.861 2.601 3.334 2.823 2.573 3.073 0.028 18 0 "[ . 1 . 2]" 1
1185 1 78 TYR H 1 79 SER H 4.661 4.000 4.899 4.517 4.419 4.600 . 0 0 "[ . 1 . 2]" 1
1186 1 78 TYR HA 1 78 TYR QD 2.675 2.192 3.264 2.897 2.726 2.983 . 0 0 "[ . 1 . 2]" 1
1187 1 78 TYR HA 1 79 SER H 2.146 . 2.501 2.237 2.183 2.337 . 0 0 "[ . 1 . 2]" 1
1188 1 78 TYR HB2 1 79 SER H 3.956 3.395 4.610 4.251 4.050 4.378 . 0 0 "[ . 1 . 2]" 1
1189 1 78 TYR HB3 1 79 SER H 3.334 2.861 3.885 3.157 2.841 3.400 0.020 18 0 "[ . 1 . 2]" 1
1190 1 78 TYR HB3 1 80 PHE QD 3.424 2.858 4.116 4.000 3.920 4.044 . 0 0 "[ . 1 . 2]" 1
1191 1 78 TYR HB3 1 80 PHE QE 3.230 2.696 3.883 2.978 2.892 3.018 . 0 0 "[ . 1 . 2]" 1
1192 1 78 TYR QR 1 80 PHE HZ 3.318 2.770 3.989 2.807 2.726 3.139 0.044 5 0 "[ . 1 . 2]" 1
1193 1 78 TYR QD 1 79 SER H 3.416 2.961 3.981 3.666 3.140 3.955 . 0 0 "[ . 1 . 2]" 1
1194 1 78 TYR QD 1 80 PHE H 4.500 4.000 1003.500 6.062 5.969 6.142 . 0 0 "[ . 1 . 2]" 1
1195 1 78 TYR QD 1 109 LEU QD 2.971 2.480 3.571 3.033 2.807 3.201 . 0 0 "[ . 1 . 2]" 1
1196 1 78 TYR QE 1 80 PHE H 4.500 4.000 1003.500 8.234 8.145 8.314 . 0 0 "[ . 1 . 2]" 1
1197 1 78 TYR QE 1 80 PHE QD 3.237 2.702 3.891 3.554 3.380 3.822 . 0 0 "[ . 1 . 2]" 1
1198 1 78 TYR QE 1 80 PHE QE 3.209 2.679 3.857 3.298 3.172 3.367 . 0 0 "[ . 1 . 2]" 1
1199 1 78 TYR QE 1 109 LEU QD 2.468 2.060 2.967 2.755 2.562 3.025 0.058 17 0 "[ . 1 . 2]" 1
1200 1 78 TYR QE 1 120 LEU MD2 3.206 2.676 3.854 2.848 2.723 2.948 . 0 0 "[ . 1 . 2]" 1
1201 1 79 SER H 1 79 SER HA 2.925 2.397 3.569 3.006 2.999 3.014 . 0 0 "[ . 1 . 2]" 1
1202 1 79 SER H 1 79 SER HB2 2.709 2.325 3.157 3.130 2.904 3.316 0.159 10 0 "[ . 1 . 2]" 1
1203 1 79 SER H 1 79 SER HB3 2.953 2.534 3.441 2.661 2.527 2.883 0.007 6 0 "[ . 1 . 2]" 1
1204 1 79 SER H 1 80 PHE H 4.805 4.124 5.599 4.117 4.031 4.177 0.093 18 0 "[ . 1 . 2]" 1
1205 1 79 SER HA 1 80 PHE H 2.300 . 2.680 2.200 2.190 2.207 . 0 0 "[ . 1 . 2]" 1
1206 1 79 SER HB2 1 81 GLY H 3.489 2.994 4.066 4.143 4.119 4.171 0.105 19 0 "[ . 1 . 2]" 1
1207 1 80 PHE H 1 80 PHE HA 2.632 2.259 3.067 3.004 2.997 3.010 . 0 0 "[ . 1 . 2]" 1
1208 1 80 PHE H 1 80 PHE HB2 2.610 2.240 3.041 2.682 2.617 2.756 . 0 0 "[ . 1 . 2]" 1
1209 1 80 PHE H 1 80 PHE QD 2.877 2.702 3.352 3.333 3.255 3.396 0.044 10 0 "[ . 1 . 2]" 1
1210 1 80 PHE H 1 81 GLY H 3.072 2.636 3.448 3.577 3.555 3.594 0.146 8 0 "[ . 1 . 2]" 1
1211 1 80 PHE HA 1 80 PHE QD 2.493 2.389 3.042 2.304 2.281 2.322 0.108 11 0 "[ . 1 . 2]" 1
1212 1 80 PHE HA 1 81 GLY H 2.703 2.640 3.150 2.475 2.452 2.489 0.188 3 0 "[ . 1 . 2]" 1
1213 1 80 PHE HB2 1 80 PHE QE 3.798 3.170 4.566 3.436 3.252 3.674 . 0 0 "[ . 1 . 2]" 1
1214 1 80 PHE HB2 1 80 PHE HZ 3.980 3.322 4.784 4.011 3.795 4.155 . 0 0 "[ . 1 . 2]" 1
1215 1 80 PHE HB2 1 81 GLY H 3.703 3.178 4.315 4.389 4.381 4.396 0.081 16 0 "[ . 1 . 2]" 1
1216 1 80 PHE HB3 1 112 TYR QD 4.199 3.505 5.047 4.101 3.758 4.431 . 0 0 "[ . 1 . 2]" 1
1217 1 80 PHE HB3 1 112 TYR QE 4.058 3.387 4.878 4.087 3.224 4.551 0.163 6 0 "[ . 1 . 2]" 1
1218 1 80 PHE HB3 1 112 TYR QE 3.708 3.095 4.457 4.253 4.178 4.306 . 0 0 "[ . 1 . 2]" 1
1219 1 80 PHE QD 1 81 GLY H 4.148 3.560 4.834 4.590 4.526 4.631 . 0 0 "[ . 1 . 2]" 1
1220 1 80 PHE QD 1 109 LEU HA 4.820 4.023 5.794 5.425 5.235 5.624 . 0 0 "[ . 1 . 2]" 1
1221 1 80 PHE QD 1 109 LEU QD 3.647 3.044 4.384 4.431 4.337 4.502 0.118 15 0 "[ . 1 . 2]" 1
1222 1 80 PHE QD 1 112 TYR QD 2.912 2.431 3.500 2.534 2.466 2.588 . 0 0 "[ . 1 . 2]" 1
1223 1 80 PHE QD 1 112 TYR QE 3.412 2.848 4.101 3.820 3.710 3.959 . 0 0 "[ . 1 . 2]" 1
1224 1 80 PHE QD 1 112 TYR HB3 4.204 3.570 4.979 4.183 3.971 4.516 . 0 0 "[ . 1 . 2]" 1
1225 1 80 PHE QE 1 109 LEU MD1 2.747 2.251 3.352 2.155 2.110 2.203 0.141 13 0 "[ . 1 . 2]" 1
1226 1 80 PHE QE 1 112 TYR QD 3.508 2.928 4.217 3.562 3.401 3.680 . 0 0 "[ . 1 . 2]" 1
1227 1 80 PHE QE 1 112 TYR QE 3.652 3.048 4.390 4.418 4.337 4.466 0.076 13 0 "[ . 1 . 2]" 1
1228 1 80 PHE QE 1 113 LEU MD2 3.017 2.473 3.681 3.315 3.009 3.684 0.003 11 0 "[ . 1 . 2]" 1
1229 1 80 PHE QE 1 109 LEU HA 3.989 3.330 4.795 4.110 3.852 4.260 . 0 0 "[ . 1 . 2]" 1
1230 1 80 PHE QE 1 109 LEU QD 2.797 2.335 3.362 2.568 2.439 2.675 . 0 0 "[ . 1 . 2]" 1
1231 1 80 PHE QE 1 112 TYR HB3 4.120 3.439 4.953 3.756 3.528 4.118 . 0 0 "[ . 1 . 2]" 1
1232 1 80 PHE HZ 1 109 LEU HA 4.055 3.385 4.874 4.710 4.612 4.858 . 0 0 "[ . 1 . 2]" 1
1233 1 80 PHE HZ 1 109 LEU QD 2.774 2.315 3.335 2.299 2.240 2.385 0.075 18 0 "[ . 1 . 2]" 1
1234 1 80 PHE HZ 1 109 LEU MD2 3.514 2.880 4.287 3.869 3.586 4.015 . 0 0 "[ . 1 . 2]" 1
1235 1 80 PHE HZ 1 112 TYR HB3 4.131 3.448 4.966 4.296 3.983 4.503 . 0 0 "[ . 1 . 2]" 1
1236 1 81 GLY H 1 81 GLY HA2 2.605 2.265 3.036 2.709 2.678 2.741 . 0 0 "[ . 1 . 2]" 1
1237 1 81 GLY H 1 81 GLY HA3 2.538 2.178 2.958 2.944 2.919 2.962 0.004 15 0 "[ . 1 . 2]" 1
1238 1 81 GLY H 1 82 GLY H 4.230 3.630 4.929 4.395 4.360 4.423 . 0 0 "[ . 1 . 2]" 1
1239 1 81 GLY HA2 1 82 GLY H 2.423 2.079 2.824 2.857 2.774 2.915 0.091 5 0 "[ . 1 . 2]" 1
1240 1 81 GLY HA2 1 83 CYS H 3.868 3.320 4.507 3.073 2.951 3.247 0.369 12 0 "[ . 1 . 2]" 1
1241 1 81 GLY HA3 1 82 GLY H 2.576 2.236 3.002 2.405 2.366 2.451 . 0 0 "[ . 1 . 2]" 1
1242 1 81 GLY HA3 1 83 CYS H 3.483 2.989 4.059 3.997 3.852 4.189 0.130 10 0 "[ . 1 . 2]" 1
1243 1 82 GLY H 1 82 GLY HA2 2.674 2.295 3.116 2.361 2.356 2.368 . 0 0 "[ . 1 . 2]" 1
1244 1 82 GLY H 1 82 GLY HA3 2.752 2.362 3.207 2.768 2.759 2.773 . 0 0 "[ . 1 . 2]" 1
1245 1 82 GLY H 1 83 CYS H 3.444 2.956 3.475 2.879 2.855 2.906 0.101 3 0 "[ . 1 . 2]" 1
1246 1 82 GLY HA2 1 83 CYS H 3.614 3.102 4.211 3.066 2.939 3.158 0.163 11 0 "[ . 1 . 2]" 1
1247 1 82 GLY HA2 1 85 ARG HB2 3.500 3.000 1002.500 2.969 2.909 3.298 0.091 8 0 "[ . 1 . 2]" 1
1248 1 82 GLY HA2 1 85 ARG HB3 3.500 3.000 1002.500 4.672 4.605 5.016 . 0 0 "[ . 1 . 2]" 1
1249 1 82 GLY HA2 1 85 ARG HD2 3.500 3.000 1002.500 3.468 2.971 4.322 0.029 19 0 "[ . 1 . 2]" 1
1250 1 82 GLY HA2 1 85 ARG HD3 3.500 3.000 1002.500 3.804 2.971 4.407 0.029 17 0 "[ . 1 . 2]" 1
1251 1 82 GLY HA2 1 85 ARG HG2 3.500 3.000 1002.500 5.316 5.009 5.643 . 0 0 "[ . 1 . 2]" 1
1252 1 82 GLY HA2 1 85 ARG HG3 3.500 3.000 1002.500 4.171 3.560 4.723 . 0 0 "[ . 1 . 2]" 1
1253 1 82 GLY HA3 1 83 CYS H 3.427 2.941 3.994 3.465 3.413 3.518 . 0 0 "[ . 1 . 2]" 1
1254 1 82 GLY HA3 1 85 ARG HB2 3.500 3.000 1002.500 3.260 3.000 3.637 0.000 19 0 "[ . 1 . 2]" 1
1255 1 82 GLY HA3 1 85 ARG HB3 3.500 3.000 1002.500 4.724 4.429 5.024 . 0 0 "[ . 1 . 2]" 1
1256 1 82 GLY HA3 1 85 ARG HD2 3.500 3.000 1002.500 4.425 3.757 5.490 . 0 0 "[ . 1 . 2]" 1
1257 1 82 GLY HA3 1 85 ARG HD3 3.500 3.000 1002.500 4.239 3.613 5.538 . 0 0 "[ . 1 . 2]" 1
1258 1 82 GLY HA3 1 85 ARG HG2 3.500 3.000 1002.500 6.023 5.722 6.529 . 0 0 "[ . 1 . 2]" 1
1259 1 82 GLY HA3 1 85 ARG HG3 3.500 3.000 1002.500 5.269 4.731 5.959 . 0 0 "[ . 1 . 2]" 1
1260 1 83 CYS H 1 83 CYS HA 2.790 2.614 3.251 2.806 2.771 2.846 . 0 0 "[ . 1 . 2]" 1
1261 1 83 CYS H 1 83 CYS HB2 2.791 2.404 3.242 2.431 2.285 2.870 0.119 18 0 "[ . 1 . 2]" 1
1262 1 83 CYS H 1 83 CYS HB3 2.771 2.378 3.229 2.962 2.754 3.518 0.289 10 0 "[ . 1 . 2]" 1
1263 1 83 CYS H 1 84 HIS H . 2.952 3.420 2.909 2.798 2.989 0.154 6 0 "[ . 1 . 2]" 1
1264 1 83 CYS HA 1 84 HIS H 3.364 2.887 3.920 3.584 3.568 3.598 . 0 0 "[ . 1 . 2]" 1
1265 1 83 CYS HA 1 86 TYR H 2.819 2.419 3.285 2.775 2.759 2.790 . 0 0 "[ . 1 . 2]" 1
1266 1 83 CYS HA 1 86 TYR QD 3.020 2.521 3.630 2.816 2.294 3.078 0.227 18 0 "[ . 1 . 2]" 1
1267 1 83 CYS HA 1 87 ALA H 3.423 2.938 3.989 3.458 3.426 3.474 . 0 0 "[ . 1 . 2]" 1
1268 1 83 CYS HB2 1 84 HIS H 3.121 2.678 3.637 3.428 2.308 3.732 0.370 4 0 "[ . 1 . 2]" 1
1269 1 83 CYS HB2 1 84 HIS HE1 4.751 3.966 5.711 4.958 3.581 5.465 0.385 16 0 "[ . 1 . 2]" 1
1270 1 83 CYS HB3 1 86 TYR QD 2.941 2.455 3.535 2.490 2.363 2.774 0.092 19 0 "[ . 1 . 2]" 1
1271 1 84 HIS H 1 84 HIS HA 2.772 2.379 3.230 2.880 2.864 2.898 . 0 0 "[ . 1 . 2]" 1
1272 1 84 HIS H 1 85 ARG H 3.188 2.736 3.421 2.714 2.679 2.762 0.057 8 0 "[ . 1 . 2]" 1
1273 1 84 HIS HA 1 84 HIS HD2 3.576 2.985 4.299 3.861 3.797 3.943 . 0 0 "[ . 1 . 2]" 1
1274 1 84 HIS HA 1 85 ARG H 3.201 2.747 3.730 3.598 3.587 3.612 . 0 0 "[ . 1 . 2]" 1
1275 1 84 HIS HA 1 86 TYR H 4.238 3.637 4.939 4.046 3.987 4.119 . 0 0 "[ . 1 . 2]" 1
1276 1 84 HIS HA 1 87 ALA H 3.636 2.980 4.436 3.273 3.163 3.418 . 0 0 "[ . 1 . 2]" 1
1277 1 84 HIS HA 1 87 ALA H 2.663 2.285 3.103 2.680 2.658 2.708 . 0 0 "[ . 1 . 2]" 1
1278 1 84 HIS HA 1 87 ALA MB 2.754 2.257 3.360 2.865 2.607 3.123 . 0 0 "[ . 1 . 2]" 1
1279 1 84 HIS HB2 1 85 ARG H 2.821 2.421 3.287 2.580 2.473 2.632 . 0 0 "[ . 1 . 2]" 1
1280 1 84 HIS HB3 1 85 ARG H 2.961 2.541 3.450 3.423 3.282 3.508 0.058 16 0 "[ . 1 . 2]" 1
1281 1 85 ARG H 1 85 ARG HA 3.068 2.514 3.743 2.832 2.822 2.840 . 0 0 "[ . 1 . 2]" 1
1282 1 85 ARG H 1 85 ARG HB2 2.543 2.182 2.963 2.359 2.236 2.517 . 0 0 "[ . 1 . 2]" 1
1283 1 85 ARG H 1 85 ARG HB3 2.543 2.182 2.963 2.458 2.120 2.725 0.062 5 0 "[ . 1 . 2]" 1
1284 1 85 ARG H 1 85 ARG HD2 3.443 2.955 4.012 3.894 3.534 4.450 0.438 17 0 "[ . 1 . 2]" 1
1285 1 85 ARG H 1 85 ARG HD3 3.712 3.186 4.326 4.272 3.811 4.461 0.135 6 0 "[ . 1 . 2]" 1
1286 1 85 ARG H 1 86 TYR H 3.077 2.641 3.166 2.728 2.694 2.760 . 0 0 "[ . 1 . 2]" 1
1287 1 85 ARG HA 1 86 TYR H 3.485 2.856 4.252 3.527 3.505 3.538 . 0 0 "[ . 1 . 2]" 1
1288 1 85 ARG HA 1 88 ALA H 3.208 2.629 3.914 3.234 3.071 3.325 . 0 0 "[ . 1 . 2]" 1
1289 1 85 ARG HA 1 88 ALA H 2.667 2.289 3.108 2.687 2.650 2.728 . 0 0 "[ . 1 . 2]" 1
1290 1 85 ARG HA 1 88 ALA MB 2.944 2.413 3.592 2.468 2.356 2.645 0.057 17 0 "[ . 1 . 2]" 1
1291 1 85 ARG HB2 1 86 TYR H 3.539 3.037 4.124 2.946 2.876 2.989 0.161 3 0 "[ . 1 . 2]" 1
1292 1 85 ARG HB2 1 89 TYR QD 2.979 2.487 3.581 2.436 2.371 2.540 0.116 18 0 "[ . 1 . 2]" 1
1293 1 85 ARG HB3 1 86 TYR H 3.568 3.062 4.158 3.475 3.358 3.559 . 0 0 "[ . 1 . 2]" 1
1294 1 85 ARG HB3 1 89 TYR QD 2.922 2.439 3.513 2.492 2.358 2.721 0.081 19 0 "[ . 1 . 2]" 1
1295 1 85 ARG HD2 1 89 TYR QE 3.258 2.720 3.916 3.183 2.959 3.363 . 0 0 "[ . 1 . 2]" 1
1296 1 86 TYR H 1 86 TYR HA 2.931 2.402 3.576 2.863 2.848 2.877 . 0 0 "[ . 1 . 2]" 1
1297 1 86 TYR H 1 86 TYR HB2 2.856 2.451 3.328 2.766 2.549 2.927 . 0 0 "[ . 1 . 2]" 1
1298 1 86 TYR H 1 86 TYR HB3 2.845 2.442 3.315 2.353 2.218 2.484 0.224 18 0 "[ . 1 . 2]" 1
1299 1 86 TYR H 1 86 TYR QD 3.413 2.967 3.977 4.130 4.094 4.171 0.194 19 0 "[ . 1 . 2]" 1
1300 1 86 TYR H 1 87 ALA H 2.941 2.653 3.427 2.693 2.618 2.792 0.035 20 0 "[ . 1 . 2]" 1
1301 1 86 TYR HA 1 86 TYR QD 3.020 2.475 3.685 2.863 2.416 3.119 0.059 18 0 "[ . 1 . 2]" 1
1302 1 86 TYR HA 1 89 TYR H 3.075 2.639 3.583 3.094 3.013 3.204 . 0 0 "[ . 1 . 2]" 1
1303 1 86 TYR HA 1 89 TYR QD 3.630 3.030 4.364 3.652 3.365 3.926 . 0 0 "[ . 1 . 2]" 1
1304 1 86 TYR HA 1 89 TYR HB3 3.411 2.796 4.162 4.016 3.719 4.219 0.057 4 0 "[ . 1 . 2]" 1
1305 1 86 TYR HB2 1 87 ALA H 3.354 2.878 3.908 3.933 3.781 3.988 0.080 15 0 "[ . 1 . 2]" 1
1306 1 86 TYR HB3 1 86 TYR QD 2.878 2.402 3.460 2.392 2.313 2.484 0.089 3 0 "[ . 1 . 2]" 1
1307 1 86 TYR HB3 1 87 ALA H 2.845 2.441 3.315 2.569 2.392 2.647 0.049 19 0 "[ . 1 . 2]" 1
1308 1 86 TYR HB3 1 97 ILE MD 2.867 2.350 3.498 2.492 2.286 3.507 0.064 11 0 "[ . 1 . 2]" 1
1309 1 86 TYR QD 1 87 ALA H 3.258 2.851 3.797 3.003 2.816 3.592 0.035 15 0 "[ . 1 . 2]" 1
1310 1 86 TYR QD 1 87 ALA HA 3.351 2.797 4.028 3.160 2.726 4.093 0.071 11 0 "[ . 1 . 2]" 1
1311 1 86 TYR QD 1 87 ALA HA 3.529 2.892 4.306 2.994 2.665 3.772 0.227 11 0 "[ . 1 . 2]" 1
1312 1 86 TYR QD 1 97 ILE MD 3.134 2.569 3.824 3.021 2.894 3.170 . 0 0 "[ . 1 . 2]" 1
1313 1 86 TYR QD 1 90 GLN HA 4.289 3.580 5.156 5.320 5.135 5.422 0.266 6 0 "[ . 1 . 2]" 1
1314 1 86 TYR QE 1 87 ALA H 4.100 3.422 4.929 5.037 4.976 5.197 0.268 19 0 "[ . 1 . 2]" 1
1315 1 86 TYR QE 1 87 ALA HA 4.055 3.385 4.875 4.004 3.739 4.453 . 0 0 "[ . 1 . 2]" 1
1316 1 86 TYR QE 1 98 PRO HD3 2.392 . 2.864 2.722 2.496 2.914 0.050 15 0 "[ . 1 . 2]" 1
1317 1 86 TYR QE 1 90 GLN HA 4.584 3.826 5.510 4.868 4.573 5.052 . 0 0 "[ . 1 . 2]" 1
1318 1 86 TYR QE 1 90 GLN QE 4.186 3.494 5.032 3.954 3.310 4.651 0.184 4 0 "[ . 1 . 2]" 1
1319 1 87 ALA H 1 87 ALA HA 3.070 2.516 3.746 2.847 2.836 2.864 . 0 0 "[ . 1 . 2]" 1
1320 1 87 ALA H 1 87 ALA MB 2.286 2.200 2.664 2.226 2.217 2.234 . 0 0 "[ . 1 . 2]" 1
1321 1 87 ALA H 1 88 ALA H 2.945 2.528 3.339 2.698 2.643 2.773 . 0 0 "[ . 1 . 2]" 1
1322 1 87 ALA H 1 89 TYR H 4.639 3.981 5.406 4.331 4.203 4.447 . 0 0 "[ . 1 . 2]" 1
1323 1 87 ALA HA 1 88 ALA H 3.370 2.892 3.927 3.542 3.515 3.573 . 0 0 "[ . 1 . 2]" 1
1324 1 87 ALA HA 1 90 GLN H 3.528 3.028 4.111 3.504 3.307 3.833 . 0 0 "[ . 1 . 2]" 1
1325 1 87 ALA HA 1 90 GLN QB 3.473 2.847 4.237 2.470 2.294 2.680 0.553 19 4 "[ - 1* . +*]" 1
1326 1 87 ALA HA 1 90 GLN QB 3.050 2.500 3.721 2.460 2.280 2.673 0.220 19 0 "[ . 1 . 2]" 1
1327 1 87 ALA HA 1 90 GLN QE 4.407 3.782 5.135 3.885 3.514 4.788 0.268 8 0 "[ . 1 . 2]" 1
1328 1 87 ALA HA 1 91 GLN H 4.139 3.552 4.823 3.978 3.571 4.576 . 0 0 "[ . 1 . 2]" 1
1329 1 87 ALA MB 1 88 ALA H 2.658 2.457 3.097 2.565 2.403 2.687 0.054 15 0 "[ . 1 . 2]" 1
1330 1 87 ALA MB 1 90 GLN H 4.641 3.983 5.408 4.613 4.448 4.881 . 0 0 "[ . 1 . 2]" 1
1331 1 87 ALA MB 1 90 GLN QE 4.764 4.088 5.552 4.429 4.081 5.205 0.007 8 0 "[ . 1 . 2]" 1
1332 1 88 ALA H 1 88 ALA HA 2.993 2.453 3.652 2.874 2.845 2.913 . 0 0 "[ . 1 . 2]" 1
1333 1 88 ALA H 1 88 ALA MB 2.286 . 2.664 2.259 2.229 2.276 . 0 0 "[ . 1 . 2]" 1
1334 1 88 ALA H 1 89 TYR H 2.921 2.579 3.404 2.693 2.580 2.811 . 0 0 "[ . 1 . 2]" 1
1335 1 88 ALA H 1 90 GLN H 4.230 3.630 4.929 3.946 3.742 4.187 . 0 0 "[ . 1 . 2]" 1
1336 1 88 ALA HA 1 90 GLN H 3.935 3.377 4.585 4.422 4.200 4.598 0.013 3 0 "[ . 1 . 2]" 1
1337 1 88 ALA HA 1 91 GLN H 3.417 2.932 3.982 3.458 3.357 3.645 . 0 0 "[ . 1 . 2]" 1
1338 1 88 ALA HA 1 91 GLN HB2 2.997 2.456 3.657 3.535 3.109 3.789 0.132 1 0 "[ . 1 . 2]" 1
1339 1 88 ALA HA 1 91 GLN HB3 3.091 2.533 3.771 2.877 2.513 3.658 0.020 17 0 "[ . 1 . 2]" 1
1340 1 88 ALA HA 1 92 LEU H 4.126 3.541 4.808 4.252 4.001 4.495 . 0 0 "[ . 1 . 2]" 1
1341 1 88 ALA MB 1 89 TYR H 2.768 2.440 3.226 2.396 2.353 2.565 0.087 5 0 "[ . 1 . 2]" 1
1342 1 88 ALA MB 1 89 TYR QD 3.823 3.191 4.596 3.319 3.172 3.671 0.019 20 0 "[ . 1 . 2]" 1
1343 1 89 TYR H 1 89 TYR HA 2.928 2.513 3.092 2.867 2.851 2.882 . 0 0 "[ . 1 . 2]" 1
1344 1 89 TYR H 1 89 TYR HB2 2.499 2.145 2.912 2.130 2.100 2.176 0.045 2 0 "[ . 1 . 2]" 1
1345 1 89 TYR H 1 89 TYR HB3 2.808 2.410 3.272 3.463 3.431 3.500 0.228 5 0 "[ . 1 . 2]" 1
1346 1 89 TYR H 1 89 TYR QD 2.503 2.276 2.917 2.751 2.559 2.961 0.044 10 0 "[ . 1 . 2]" 1
1347 1 89 TYR H 1 90 GLN H 2.996 2.637 3.491 2.617 2.571 2.689 0.066 11 0 "[ . 1 . 2]" 1
1348 1 89 TYR HA 1 89 TYR QD 2.900 2.582 3.538 2.879 2.648 3.002 . 0 0 "[ . 1 . 2]" 1
1349 1 89 TYR HA 1 90 GLN H 3.865 3.317 4.504 3.546 3.520 3.571 . 0 0 "[ . 1 . 2]" 1
1350 1 89 TYR HA 1 91 GLN H 4.881 4.189 5.688 4.300 4.169 4.567 0.020 4 0 "[ . 1 . 2]" 1
1351 1 89 TYR HA 1 92 LEU H 3.428 2.942 3.493 3.453 3.310 3.552 0.059 3 0 "[ . 1 . 2]" 1
1352 1 89 TYR HA 1 92 LEU QD . 2.717 3.121 2.800 2.680 3.104 0.037 2 0 "[ . 1 . 2]" 1
1353 1 89 TYR HA 1 94 ARG H 4.445 3.815 5.180 4.361 4.139 4.674 . 0 0 "[ . 1 . 2]" 1
1354 1 89 TYR HB2 1 90 GLN H 3.307 2.838 3.854 2.887 2.784 3.044 0.054 10 0 "[ . 1 . 2]" 1
1355 1 89 TYR HB3 1 90 GLN H 3.625 3.111 4.224 3.286 3.108 3.465 0.003 16 0 "[ . 1 . 2]" 1
1356 1 89 TYR HB3 1 94 ARG H 4.976 4.270 5.799 4.708 4.492 5.018 . 0 0 "[ . 1 . 2]" 1
1357 1 89 TYR QD 1 90 GLN H 4.107 3.525 4.786 4.559 4.492 4.666 . 0 0 "[ . 1 . 2]" 1
1358 1 89 TYR QD 1 92 LEU QD 3.886 3.244 4.671 3.814 3.513 4.101 . 0 0 "[ . 1 . 2]" 1
1359 1 89 TYR QD 1 94 ARG H 3.827 3.284 4.460 4.462 4.253 4.538 0.078 16 0 "[ . 1 . 2]" 1
1360 1 89 TYR QD 1 94 ARG H 3.841 3.206 4.617 4.208 4.107 4.327 . 0 0 "[ . 1 . 2]" 1
1361 1 89 TYR QD 1 94 ARG QD 3.718 3.103 4.469 4.336 3.964 4.579 0.110 11 0 "[ . 1 . 2]" 1
1362 1 89 TYR QD 1 94 ARG HG2 3.556 2.968 4.275 4.056 3.674 4.273 . 0 0 "[ . 1 . 2]" 1
1363 1 89 TYR QD 1 96 THR H 4.915 4.218 5.728 5.185 4.801 5.611 . 0 0 "[ . 1 . 2]" 1
1364 1 89 TYR QD 1 97 ILE HA 3.372 2.815 4.053 3.518 3.313 3.726 . 0 0 "[ . 1 . 2]" 1
1365 1 89 TYR QD 1 97 ILE MD 2.925 2.397 3.569 2.501 2.361 2.971 0.036 1 0 "[ . 1 . 2]" 1
1366 1 89 TYR QD 1 97 ILE QG 3.978 3.320 4.459 2.945 2.726 3.096 0.594 15 3 "[ . 1 + *-]" 1
1367 1 89 TYR QD 1 98 PRO HD3 4.179 3.488 5.024 4.328 4.159 4.569 . 0 0 "[ . 1 . 2]" 1
1368 1 89 TYR QE 1 94 ARG QD 3.721 3.106 4.473 4.284 3.638 4.500 0.027 20 0 "[ . 1 . 2]" 1
1369 1 89 TYR QE 1 97 ILE HA 3.023 2.523 3.634 3.085 2.591 3.657 0.023 19 0 "[ . 1 . 2]" 1
1370 1 89 TYR QE 1 97 ILE QG 3.537 2.952 4.252 2.975 2.882 3.253 0.070 6 0 "[ . 1 . 2]" 1
1371 1 89 TYR QE 1 98 PRO HD3 3.060 2.554 3.679 2.723 2.497 2.914 0.057 18 0 "[ . 1 . 2]" 1
1372 1 89 TYR QE 1 98 PRO HG3 3.626 3.027 4.359 4.160 3.710 4.614 0.255 5 0 "[ . 1 . 2]" 1
1373 1 90 GLN H 1 90 GLN HA 2.758 2.692 3.214 2.845 2.811 2.876 . 0 0 "[ . 1 . 2]" 1
1374 1 90 GLN H 1 90 GLN QB 2.672 2.293 3.114 2.231 2.169 2.260 0.124 12 0 "[ . 1 . 2]" 1
1375 1 90 GLN H 1 90 GLN QB 2.600 2.231 3.030 2.225 2.166 2.254 0.065 12 0 "[ . 1 . 2]" 1
1376 1 90 GLN H 1 90 GLN QE 6.008 5.156 6.223 5.074 4.861 5.651 0.295 6 0 "[ . 1 . 2]" 1
1377 1 90 GLN H 1 90 GLN HG2 3.621 3.107 4.219 4.418 4.331 4.548 0.329 17 0 "[ . 1 . 2]" 1
1378 1 90 GLN H 1 91 GLN H 2.927 2.512 3.327 2.648 2.493 2.842 0.019 6 0 "[ . 1 . 2]" 1
1379 1 90 GLN HA 1 90 GLN QE . 4.381 5.097 4.570 4.198 4.811 0.183 4 0 "[ . 1 . 2]" 1
1380 1 90 GLN HA 1 90 GLN HG2 2.812 2.305 3.431 2.569 2.293 3.145 0.012 19 0 "[ . 1 . 2]" 1
1381 1 90 GLN HA 1 91 GLN H 3.298 2.703 4.024 3.545 3.517 3.578 . 0 0 "[ . 1 . 2]" 1
1382 1 90 GLN HA 1 91 GLN H 2.504 2.149 2.918 2.750 2.714 2.771 . 0 0 "[ . 1 . 2]" 1
1383 1 90 GLN HA 1 92 LEU H 3.093 2.654 3.604 3.455 3.357 3.500 . 0 0 "[ . 1 . 2]" 1
1384 1 90 GLN QB 1 90 GLN QE 4.523 3.881 5.271 2.640 2.414 3.652 1.467 14 19 "[*********** *+***-**]" 1
1385 1 90 GLN QB 1 90 GLN QE 3.083 2.646 3.447 2.341 2.235 2.593 0.411 19 0 "[ . 1 . 2]" 1
1386 1 90 GLN QB 1 91 GLN H 3.300 2.832 3.845 2.576 2.314 2.814 0.518 1 1 "[+ . 1 . 2]" 1
1387 1 90 GLN QE 1 90 GLN HG2 3.469 2.977 3.814 2.946 2.400 3.382 0.577 17 3 "[ * . -1 . + 2]" 1
1388 1 91 GLN H 1 91 GLN HA 2.909 2.657 3.549 2.865 2.812 2.897 . 0 0 "[ . 1 . 2]" 1
1389 1 91 GLN H 1 91 GLN HB2 2.624 2.252 3.058 2.594 2.203 2.762 0.049 7 0 "[ . 1 . 2]" 1
1390 1 91 GLN H 1 91 GLN HB3 2.484 2.132 2.895 2.499 2.347 2.977 0.082 7 0 "[ . 1 . 2]" 1
1391 1 91 GLN H 1 91 GLN HG2 3.791 3.253 4.418 4.432 4.347 4.504 0.086 13 0 "[ . 1 . 2]" 1
1392 1 91 GLN H 1 92 LEU H 2.865 2.459 3.339 2.718 2.547 2.907 . 0 0 "[ . 1 . 2]" 1
1393 1 91 GLN H 1 93 GLN H 4.654 3.994 5.364 3.971 3.931 4.050 0.063 14 0 "[ . 1 . 2]" 1
1394 1 91 GLN HA 1 91 GLN HG2 2.812 2.305 3.431 3.076 2.310 3.518 0.087 15 0 "[ . 1 . 2]" 1
1395 1 91 GLN HA 1 92 LEU H 3.271 2.681 3.991 3.573 3.527 3.591 . 0 0 "[ . 1 . 2]" 1
1396 1 91 GLN HA 1 93 GLN H 3.581 2.935 4.369 3.418 3.306 3.566 . 0 0 "[ . 1 . 2]" 1
1397 1 92 LEU H 1 92 LEU HA 2.784 2.389 3.244 2.885 2.859 2.937 . 0 0 "[ . 1 . 2]" 1
1398 1 92 LEU H 1 92 LEU HB2 2.814 2.415 3.279 2.509 2.068 2.587 0.347 13 0 "[ . 1 . 2]" 1
1399 1 92 LEU H 1 92 LEU HB3 2.356 2.022 2.745 2.143 1.991 3.248 0.503 13 1 "[ . 1 + . 2]" 1
1400 1 92 LEU H 1 92 LEU QD 3.060 2.838 3.566 3.001 2.573 3.177 0.265 13 0 "[ . 1 . 2]" 1
1401 1 92 LEU H 1 93 GLN H 2.807 2.409 3.271 2.783 2.582 2.885 . 0 0 "[ . 1 . 2]" 1
1402 1 92 LEU H 1 93 GLN H 2.514 2.157 2.930 2.547 2.406 2.665 . 0 0 "[ . 1 . 2]" 1
1403 1 92 LEU HA 1 93 GLN H 3.463 2.972 4.035 3.221 3.147 3.301 . 0 0 "[ . 1 . 2]" 1
1404 1 92 LEU HB2 1 93 GLN H 4.185 3.592 4.877 3.690 3.585 3.784 0.007 15 0 "[ . 1 . 2]" 1
1405 1 92 LEU HB3 1 93 GLN H 3.576 3.069 4.167 3.969 3.847 4.018 . 0 0 "[ . 1 . 2]" 1
1406 1 92 LEU QD 1 93 GLN H 5.410 4.643 6.304 4.372 4.277 4.435 0.366 13 0 "[ . 1 . 2]" 1
1407 1 93 GLN H 1 93 GLN HA 2.136 . 2.489 2.348 2.337 2.354 . 0 0 "[ . 1 . 2]" 1
1408 1 93 GLN H 1 93 GLN HB2 3.267 2.678 3.986 3.483 2.931 3.989 0.003 6 0 "[ . 1 . 2]" 1
1409 1 93 GLN H 1 93 GLN QB 2.532 2.173 2.950 2.582 2.382 2.855 . 0 0 "[ . 1 . 2]" 1
1410 1 93 GLN H 1 93 GLN HB3 3.245 2.660 3.959 3.761 2.975 4.044 0.085 10 0 "[ . 1 . 2]" 1
1411 1 93 GLN H 1 94 ARG H 2.737 2.349 3.189 2.962 2.813 3.198 0.009 3 0 "[ . 1 . 2]" 1
1412 1 93 GLN HA 1 93 GLN HE21 4.817 4.134 5.613 4.209 4.071 4.561 0.063 11 0 "[ . 1 . 2]" 1
1413 1 93 GLN HA 1 93 GLN HE22 4.713 4.045 5.492 4.942 4.031 5.645 0.153 6 0 "[ . 1 . 2]" 1
1414 1 93 GLN HA 1 94 ARG H 2.662 2.285 3.102 2.878 2.612 3.108 0.006 20 0 "[ . 1 . 2]" 1
1415 1 93 GLN QB 1 94 ARG H 2.791 2.395 3.252 3.205 3.063 3.282 0.030 16 0 "[ . 1 . 2]" 1
1416 1 94 ARG H 1 94 ARG HA 3.069 2.634 3.576 2.900 2.804 2.982 . 0 0 "[ . 1 . 2]" 1
1417 1 94 ARG H 1 94 ARG HB2 2.702 2.319 3.149 2.357 2.285 2.465 0.034 13 0 "[ . 1 . 2]" 1
1418 1 94 ARG H 1 94 ARG QD 3.655 3.137 4.259 4.129 3.821 4.324 0.065 19 0 "[ . 1 . 2]" 1
1419 1 94 ARG H 1 94 ARG QG 2.841 2.438 3.311 2.544 2.421 2.779 0.017 7 0 "[ . 1 . 2]" 1
1420 1 94 ARG H 1 95 GLU H 3.869 3.320 4.509 4.635 4.582 4.675 0.166 10 0 "[ . 1 . 2]" 1
1421 1 94 ARG H 1 95 GLU H 2.599 2.230 3.029 2.541 2.495 2.587 . 0 0 "[ . 1 . 2]" 1
1422 1 94 ARG HA 1 94 ARG QD 2.526 2.070 3.082 2.322 2.185 2.516 . 0 0 "[ . 1 . 2]" 1
1423 1 94 ARG HA 1 94 ARG QG 3.313 2.721 4.042 2.645 2.495 2.858 0.226 13 0 "[ . 1 . 2]" 1
1424 1 94 ARG HA 1 95 GLU H 2.352 2.352 2.741 2.340 2.289 2.384 0.063 13 0 "[ . 1 . 2]" 1
1425 1 94 ARG HA 1 96 THR H 3.747 3.216 4.366 4.444 4.378 4.518 0.152 12 0 "[ . 1 . 2]" 1
1426 1 94 ARG HB2 1 95 GLU H 3.736 3.206 4.354 3.911 3.722 4.083 . 0 0 "[ . 1 . 2]" 1
1427 1 94 ARG HB2 1 96 THR H 4.141 3.554 4.825 4.328 4.104 4.599 . 0 0 "[ . 1 . 2]" 1
1428 1 94 ARG HB3 1 95 GLU H 3.002 2.576 3.498 2.661 2.489 2.843 0.087 10 0 "[ . 1 . 2]" 1
1429 1 94 ARG HB3 1 96 THR H 3.344 2.870 3.897 2.960 2.800 3.133 0.070 20 0 "[ . 1 . 2]" 1
1430 1 94 ARG QD 1 95 GLU H 3.510 3.012 4.090 3.269 2.993 3.719 0.019 1 0 "[ . 1 . 2]" 1
1431 1 94 ARG QD 1 96 THR H 4.714 4.045 5.493 4.406 4.027 5.100 0.018 10 0 "[ . 1 . 2]" 1
1432 1 95 GLU H 1 95 GLU HA 2.719 2.415 3.168 2.923 2.901 2.940 . 0 0 "[ . 1 . 2]" 1
1433 1 95 GLU H 1 95 GLU QB 2.543 2.182 2.963 2.255 2.166 2.426 0.016 13 0 "[ . 1 . 2]" 1
1434 1 95 GLU H 1 95 GLU HG3 3.434 2.947 4.002 3.608 2.772 4.478 0.476 16 0 "[ . 1 . 2]" 1
1435 1 95 GLU H 1 96 THR H 3.086 2.648 3.596 2.553 2.506 2.600 0.142 3 0 "[ . 1 . 2]" 1
1436 1 95 GLU HA 1 95 GLU HG2 2.845 2.332 3.471 3.090 2.347 3.607 0.136 8 0 "[ . 1 . 2]" 1
1437 1 95 GLU HA 1 95 GLU HG3 2.941 2.410 3.588 2.618 2.340 3.632 0.070 9 0 "[ . 1 . 2]" 1
1438 1 95 GLU HA 1 96 THR H 3.615 3.102 3.738 3.592 3.583 3.602 . 0 0 "[ . 1 . 2]" 1
1439 1 95 GLU HA 1 96 THR MG 3.589 2.941 4.379 4.176 4.089 4.370 . 0 0 "[ . 1 . 2]" 1
1440 1 95 GLU QB 1 96 THR H 3.165 2.716 3.688 2.654 2.614 2.698 0.102 9 0 "[ . 1 . 2]" 1
1441 1 96 THR H 1 96 THR HA . 2.979 3.470 3.014 3.009 3.024 . 0 0 "[ . 1 . 2]" 1
1442 1 96 THR H 1 96 THR HB 4.409 3.784 5.138 3.789 3.746 3.818 0.038 19 0 "[ . 1 . 2]" 1
1443 1 96 THR H 1 96 THR MG 3.213 2.757 3.744 3.083 3.036 3.140 . 0 0 "[ . 1 . 2]" 1
1444 1 96 THR H 1 97 ILE H 4.069 3.947 4.742 4.466 4.452 4.489 . 0 0 "[ . 1 . 2]" 1
1445 1 96 THR HA 1 96 THR HB 2.286 . 2.789 2.526 2.500 2.554 . 0 0 "[ . 1 . 2]" 1
1446 1 96 THR HA 1 96 THR MG 2.263 . 2.761 2.304 2.257 2.335 . 0 0 "[ . 1 . 2]" 1
1447 1 96 THR HA 1 97 ILE H 2.366 2.030 2.653 2.539 2.520 2.555 . 0 0 "[ . 1 . 2]" 1
1448 1 96 THR HB 1 97 ILE H 2.365 2.030 2.756 2.131 2.096 2.179 . 0 0 "[ . 1 . 2]" 1
1449 1 96 THR MG 1 97 ILE H . 2.778 3.378 3.550 3.481 3.606 0.228 6 0 "[ . 1 . 2]" 1
1450 1 96 THR MG 1 97 ILE H 2.899 2.488 3.378 3.369 3.335 3.400 0.022 6 0 "[ . 1 . 2]" 1
1451 1 97 ILE H 1 97 ILE HA 3.188 2.736 3.715 2.980 2.969 2.986 . 0 0 "[ . 1 . 2]" 1
1452 1 97 ILE H 1 97 ILE HB 3.393 2.912 3.954 3.080 2.878 3.171 0.034 19 0 "[ . 1 . 2]" 1
1453 1 97 ILE H 1 97 ILE MD 4.327 3.546 5.279 4.708 4.600 4.757 . 0 0 "[ . 1 . 2]" 1
1454 1 97 ILE H 1 97 ILE QG 4.937 4.237 5.753 4.193 4.152 4.270 0.085 12 0 "[ . 1 . 2]" 1
1455 1 97 ILE H 1 97 ILE MG 2.345 2.099 2.733 2.340 2.229 2.665 . 0 0 "[ . 1 . 2]" 1
1456 1 97 ILE HA 1 97 ILE MD 3.022 2.477 3.688 3.616 3.340 3.684 . 0 0 "[ . 1 . 2]" 1
1457 1 97 ILE HA 1 97 ILE QG 2.858 2.342 3.487 2.231 2.162 2.258 0.180 19 0 "[ . 1 . 2]" 1
1458 1 97 ILE HA 1 97 ILE MG 3.038 2.490 3.690 3.201 3.194 3.213 . 0 0 "[ . 1 . 2]" 1
1459 1 97 ILE HA 1 98 PRO HD2 2.517 2.063 3.071 2.832 2.730 2.957 . 0 0 "[ . 1 . 2]" 1
1460 1 97 ILE HA 1 98 PRO HD3 2.306 . 2.814 2.147 2.059 2.222 . 0 0 "[ . 1 . 2]" 1
1461 1 97 ILE MD 1 97 ILE QG 2.134 2.125 2.604 1.912 1.899 1.917 0.226 20 0 "[ . 1 . 2]" 1
1462 1 97 ILE QG 1 98 PRO HD2 2.217 . 2.705 2.070 2.010 2.228 . 0 0 "[ . 1 . 2]" 1
1463 1 97 ILE QG 1 98 PRO HD3 2.243 . 2.737 2.828 2.717 2.925 0.188 20 0 "[ . 1 . 2]" 1
1464 1 97 ILE MG 1 99 ALA MB 2.840 2.328 3.465 2.700 2.557 2.835 . 0 0 "[ . 1 . 2]" 1
1465 1 98 PRO HA 1 99 ALA H 2.104 . 2.452 2.208 2.187 2.231 . 0 0 "[ . 1 . 2]" 1
1466 1 98 PRO HA 1 99 ALA MB 3.533 2.896 4.311 4.018 3.987 4.046 . 0 0 "[ . 1 . 2]" 1
1467 1 98 PRO HB3 1 99 ALA H 3.122 2.679 3.638 3.942 3.598 4.180 0.542 16 7 "[ -*. * *** .+ 2]" 1
1468 1 99 ALA H 1 99 ALA HA 3.160 2.712 3.682 2.961 2.938 2.987 . 0 0 "[ . 1 . 2]" 1
1469 1 99 ALA H 1 99 ALA MB 2.641 2.310 3.078 2.659 2.555 2.751 . 0 0 "[ . 1 . 2]" 1
1470 1 99 ALA HA 1 100 LYS H 2.072 . 2.414 2.233 2.193 2.277 . 0 0 "[ . 1 . 2]" 1
1471 1 99 ALA MB 1 100 LYS H 2.933 2.404 3.579 2.899 2.802 3.071 . 0 0 "[ . 1 . 2]" 1
1472 1 99 ALA MB 1 101 LEU MD2 3.116 2.554 3.611 2.979 2.843 3.087 . 0 0 "[ . 1 . 2]" 1
1473 1 100 LYS H 1 100 LYS HA 3.175 2.725 3.700 2.919 2.897 2.939 . 0 0 "[ . 1 . 2]" 1
1474 1 100 LYS H 1 100 LYS HB2 2.905 2.493 3.385 2.278 2.161 2.373 0.332 20 0 "[ . 1 . 2]" 1
1475 1 100 LYS H 1 100 LYS HB3 2.701 2.318 3.147 3.062 2.818 3.534 0.387 8 0 "[ . 1 . 2]" 1
1476 1 100 LYS H 1 100 LYS QG 3.476 2.983 4.051 3.674 2.764 3.931 0.219 8 0 "[ . 1 . 2]" 1
1477 1 100 LYS HA 1 101 LEU H 2.077 . 2.420 2.205 2.181 2.242 . 0 0 "[ . 1 . 2]" 1
1478 1 100 LYS HB2 1 101 LEU H 3.747 3.216 4.366 4.543 4.481 4.679 0.313 13 0 "[ . 1 . 2]" 1
1479 1 100 LYS QG 1 101 LEU H 3.693 3.169 4.303 3.358 2.774 4.212 0.395 11 0 "[ . 1 . 2]" 1
1480 1 101 LEU H 1 101 LEU HA 3.026 2.597 3.526 2.946 2.891 2.979 . 0 0 "[ . 1 . 2]" 1
1481 1 101 LEU H 1 101 LEU HB3 2.545 2.184 2.966 2.287 2.191 2.397 . 0 0 "[ . 1 . 2]" 1
1482 1 101 LEU H 1 101 LEU MD1 3.933 3.375 4.583 3.797 3.714 3.885 . 0 0 "[ . 1 . 2]" 1
1483 1 101 LEU H 1 101 LEU MD2 3.677 3.156 4.285 3.148 3.107 3.229 0.049 8 0 "[ . 1 . 2]" 1
1484 1 101 LEU HA 1 101 LEU MD1 3.764 3.085 4.593 3.785 3.768 3.802 . 0 0 "[ . 1 . 2]" 1
1485 1 101 LEU HA 1 101 LEU MD2 2.514 2.239 3.067 2.092 2.077 2.104 0.162 6 0 "[ . 1 . 2]" 1
1486 1 101 LEU HA 1 102 VAL H 1.981 . 2.309 2.193 2.160 2.219 . 0 0 "[ . 1 . 2]" 1
1487 1 101 LEU HB2 1 102 VAL H 3.408 2.925 3.971 4.001 3.952 4.039 0.068 4 0 "[ . 1 . 2]" 1
1488 1 101 LEU HB3 1 102 VAL H 3.154 2.707 3.675 3.077 2.987 3.138 . 0 0 "[ . 1 . 2]" 1
1489 1 101 LEU MD1 1 102 VAL H 4.031 3.304 4.918 4.824 4.740 4.871 . 0 0 "[ . 1 . 2]" 1
1490 1 101 LEU MD2 1 102 VAL H 3.154 2.773 3.675 3.577 3.520 3.613 . 0 0 "[ . 1 . 2]" 1
1491 1 102 VAL H 1 102 VAL HA 2.797 2.494 3.259 2.997 2.991 3.001 . 0 0 "[ . 1 . 2]" 1
1492 1 102 VAL H 1 102 VAL HB 2.380 2.043 2.773 2.595 2.553 2.683 . 0 0 "[ . 1 . 2]" 1
1493 1 102 VAL H 1 102 VAL MG1 3.087 2.530 3.767 3.812 3.780 3.876 0.109 3 0 "[ . 1 . 2]" 1
1494 1 102 VAL H 1 102 VAL QG 2.337 2.006 2.723 2.868 2.789 2.916 0.193 10 0 "[ . 1 . 2]" 1
1495 1 102 VAL H 1 102 VAL MG2 3.786 3.103 4.619 2.967 2.859 3.028 0.244 3 0 "[ . 1 . 2]" 1
1496 1 102 VAL HA 1 102 VAL HB 2.903 2.379 3.542 3.032 3.029 3.037 . 0 0 "[ . 1 . 2]" 1
1497 1 102 VAL HA 1 102 VAL MG1 2.958 2.424 3.609 2.413 2.350 2.459 0.074 3 0 "[ . 1 . 2]" 1
1498 1 102 VAL HA 1 102 VAL MG2 2.908 2.383 3.548 2.350 2.324 2.402 0.059 15 0 "[ . 1 . 2]" 1
1499 1 102 VAL HA 1 103 GLN H 2.602 2.133 3.175 2.237 2.223 2.247 . 0 0 "[ . 1 . 2]" 1
1500 1 102 VAL QG 1 103 GLN H 3.446 2.957 4.016 3.164 3.123 3.196 . 0 0 "[ . 1 . 2]" 1
1501 1 102 VAL QG 1 103 GLN HE21 4.623 3.967 5.387 5.430 5.415 5.437 0.050 4 0 "[ . 1 . 2]" 1
1502 1 102 VAL MG1 1 103 GLN H 4.108 3.367 5.012 3.276 3.226 3.318 0.141 11 0 "[ . 1 . 2]" 1
1503 1 103 GLN H 1 103 GLN QB 2.752 2.362 3.207 2.275 2.269 2.277 0.093 13 0 "[ . 1 . 2]" 1
1504 1 103 GLN HA 1 103 GLN HE21 3.401 2.787 4.150 3.010 2.775 3.366 0.012 4 0 "[ . 1 . 2]" 1
1505 1 103 GLN HA 1 103 GLN QG 3.423 2.806 4.176 2.709 2.300 3.077 0.506 2 8 "[ + ** * 1-** * 2]" 1
1506 1 103 GLN HA 1 104 SER H 2.110 . 2.459 2.208 2.192 2.229 . 0 0 "[ . 1 . 2]" 1
1507 1 103 GLN QB 1 103 GLN HE21 2.747 2.357 3.202 2.248 2.236 2.259 0.121 10 0 "[ . 1 . 2]" 1
1508 1 103 GLN QB 1 103 GLN HE22 3.034 2.604 3.537 3.190 3.166 3.209 . 0 0 "[ . 1 . 2]" 1
1509 1 103 GLN QB 1 104 SER H 2.955 2.536 3.443 2.865 2.602 3.086 . 0 0 "[ . 1 . 2]" 1
1510 1 103 GLN HE21 1 103 GLN QG 2.872 2.464 3.346 2.269 2.255 2.281 0.209 10 0 "[ . 1 . 2]" 1
1511 1 103 GLN HE22 1 103 GLN QG 3.363 2.886 3.919 3.317 3.314 3.321 . 0 0 "[ . 1 . 2]" 1
1512 1 103 GLN QG 1 104 SER H 4.503 3.865 5.247 2.976 2.656 3.263 1.209 10 20 [**-******+**********] 1
1513 1 104 SER H 1 104 SER HA 3.189 2.737 3.716 2.986 2.971 2.993 . 0 0 "[ . 1 . 2]" 1
1514 1 104 SER H 1 104 SER HB2 2.945 2.527 3.036 2.660 2.614 2.725 . 0 0 "[ . 1 . 2]" 1
1515 1 104 SER H 1 104 SER HB3 3.370 2.892 3.721 3.782 3.750 3.817 0.096 10 0 "[ . 1 . 2]" 1
1516 1 104 SER H 1 105 THR H 4.478 4.162 5.218 4.418 4.409 4.430 . 0 0 "[ . 1 . 2]" 1
1517 1 104 SER HA 1 105 THR H 2.278 2.055 2.655 2.587 2.552 2.617 . 0 0 "[ . 1 . 2]" 1
1518 1 104 SER HA 1 105 THR MG 3.211 3.089 3.918 3.585 3.547 3.641 . 0 0 "[ . 1 . 2]" 1
1519 1 104 SER HB2 1 105 THR H 3.235 2.776 3.335 3.498 3.482 3.517 0.182 19 0 "[ . 1 . 2]" 1
1520 1 104 SER HB3 1 105 THR H 2.618 2.247 2.994 2.116 2.107 2.130 0.140 7 0 "[ . 1 . 2]" 1
1521 1 104 SER HB3 1 108 ASP HB2 2.735 2.347 3.337 3.086 2.328 3.418 0.081 12 0 "[ . 1 . 2]" 1
1522 1 104 SER HB3 1 108 ASP HB3 2.549 2.124 3.110 2.482 2.332 3.381 0.271 20 0 "[ . 1 . 2]" 1
1523 1 105 THR H 1 105 THR HA 3.463 2.972 4.035 3.003 3.000 3.007 . 0 0 "[ . 1 . 2]" 1
1524 1 105 THR H 1 105 THR HB 3.003 2.461 3.664 3.698 3.677 3.722 0.058 12 0 "[ . 1 . 2]" 1
1525 1 105 THR H 1 105 THR MG 2.732 2.551 3.184 2.990 2.935 3.087 . 0 0 "[ . 1 . 2]" 1
1526 1 105 THR H 1 106 LEU H 4.339 3.851 5.056 4.516 4.462 4.538 . 0 0 "[ . 1 . 2]" 1
1527 1 105 THR H 1 108 ASP H 3.421 2.936 3.987 3.393 3.213 3.545 . 0 0 "[ . 1 . 2]" 1
1528 1 105 THR H 1 108 ASP H 3.412 2.928 3.976 3.291 3.131 3.423 . 0 0 "[ . 1 . 2]" 1
1529 1 105 THR H 1 108 ASP HA 4.693 4.028 5.469 5.165 5.015 5.386 . 0 0 "[ . 1 . 2]" 1
1530 1 105 THR H 1 108 ASP HB2 3.264 2.801 3.804 2.847 2.443 3.239 0.358 6 0 "[ . 1 . 2]" 1
1531 1 105 THR H 1 108 ASP HB3 2.889 2.479 3.367 3.017 2.478 3.855 0.488 13 0 "[ . 1 . 2]" 1
1532 1 105 THR H 1 109 LEU H 4.113 3.530 4.783 4.449 4.210 4.590 . 0 0 "[ . 1 . 2]" 1
1533 1 105 THR HA 1 105 THR MG 2.396 2.278 2.923 2.300 2.291 2.308 . 0 0 "[ . 1 . 2]" 1
1534 1 105 THR HA 1 106 LEU H 2.653 2.277 2.925 2.429 2.384 2.529 . 0 0 "[ . 1 . 2]" 1
1535 1 105 THR HB 1 106 LEU H 2.501 2.147 2.914 2.497 2.198 2.614 . 0 0 "[ . 1 . 2]" 1
1536 1 105 THR MG 1 106 LEU H 3.257 2.795 3.795 3.542 3.435 3.586 . 0 0 "[ . 1 . 2]" 1
1537 1 106 LEU H 1 106 LEU HA 2.909 2.645 3.390 2.811 2.794 2.851 . 0 0 "[ . 1 . 2]" 1
1538 1 106 LEU H 1 106 LEU HB2 2.296 . 2.676 2.182 2.061 2.454 . 0 0 "[ . 1 . 2]" 1
1539 1 106 LEU H 1 106 LEU HB3 3.020 2.592 3.519 3.089 2.712 3.667 0.148 10 0 "[ . 1 . 2]" 1
1540 1 106 LEU H 1 106 LEU MD1 3.824 3.660 4.456 3.944 3.680 4.359 . 0 0 "[ . 1 . 2]" 1
1541 1 106 LEU H 1 107 SER H 3.505 3.008 4.085 2.856 2.796 2.890 0.212 12 0 "[ . 1 . 2]" 1
1542 1 106 LEU HA 1 106 LEU QD 2.804 2.298 3.421 2.367 2.045 2.661 0.253 12 0 "[ . 1 . 2]" 1
1543 1 106 LEU HA 1 106 LEU MD1 2.743 2.248 3.347 3.096 2.154 3.729 0.382 10 0 "[ . 1 . 2]" 1
1544 1 106 LEU HA 1 106 LEU MD2 3.361 2.755 4.101 2.758 2.123 3.684 0.632 10 5 "[ . * + * - * 2]" 1
1545 1 106 LEU HA 1 108 ASP H 2.788 2.285 3.402 3.265 3.071 3.438 0.036 12 0 "[ . 1 . 2]" 1
1546 1 106 LEU HA 1 109 LEU H 3.173 2.723 3.698 3.351 3.137 3.548 . 0 0 "[ . 1 . 2]" 1
1547 1 106 LEU HA 1 109 LEU HB2 3.529 2.892 4.306 2.937 2.717 3.232 0.175 2 0 "[ . 1 . 2]" 1
1548 1 106 LEU HA 1 109 LEU HB3 3.178 2.605 3.877 3.154 2.575 3.387 0.030 10 0 "[ . 1 . 2]" 1
1549 1 106 LEU HA 1 109 LEU QD 2.931 2.402 3.576 3.483 3.330 3.645 0.069 15 0 "[ . 1 . 2]" 1
1550 1 106 LEU HA 1 109 LEU MD2 3.305 2.709 4.032 3.336 3.119 3.507 . 0 0 "[ . 1 . 2]" 1
1551 1 106 LEU HA 1 110 ARG H 3.853 3.307 4.490 4.441 3.786 4.576 0.086 7 0 "[ . 1 . 2]" 1
1552 1 106 LEU QD 1 107 SER H 3.708 3.182 4.321 3.345 3.186 3.497 . 0 0 "[ . 1 . 2]" 1
1553 1 106 LEU QD 1 109 LEU H 3.642 3.126 4.244 4.250 4.047 4.395 0.151 10 0 "[ . 1 . 2]" 1
1554 1 106 LEU MD1 1 109 LEU QD 2.805 2.299 3.422 2.717 2.124 3.628 0.206 10 0 "[ . 1 . 2]" 1
1555 1 106 LEU MD1 1 117 THR MG 3.487 2.858 4.254 3.566 2.492 4.308 0.366 15 0 "[ . 1 . 2]" 1
1556 1 106 LEU MD1 1 119 ASP HA 3.945 3.233 4.813 4.034 3.523 4.559 . 0 0 "[ . 1 . 2]" 1
1557 1 106 LEU MD1 1 120 LEU H 3.852 3.157 4.700 3.573 3.095 4.448 0.062 14 0 "[ . 1 . 2]" 1
1558 1 106 LEU MD1 1 120 LEU MD2 4.500 4.000 1003.500 4.695 4.048 5.617 . 0 0 "[ . 1 . 2]" 1
1559 1 106 LEU MD2 1 109 LEU QD 2.987 2.448 3.644 2.914 2.199 3.779 0.249 18 0 "[ . 1 . 2]" 1
1560 1 106 LEU MD2 1 120 LEU H 4.017 3.292 4.901 3.919 3.068 4.244 0.224 12 0 "[ . 1 . 2]" 1
1561 1 106 LEU MD2 1 117 THR MG 2.824 2.297 3.468 2.904 2.324 3.692 0.224 7 0 "[ . 1 . 2]" 1
1562 1 106 LEU MD2 1 119 ASP HA 3.412 3.237 4.163 4.292 4.097 4.531 0.368 10 0 "[ . 1 . 2]" 1
1563 1 106 LEU MD2 1 120 LEU H 3.751 3.219 4.371 4.012 3.089 4.385 0.130 12 0 "[ . 1 . 2]" 1
1564 1 106 LEU MD2 1 120 LEU MD2 4.500 4.000 1003.500 4.880 4.193 5.711 . 0 0 "[ . 1 . 2]" 1
1565 1 107 SER H 1 107 SER HA 3.487 2.858 4.255 2.824 2.813 2.881 0.045 6 0 "[ . 1 . 2]" 1
1566 1 107 SER H 1 107 SER HB2 3.050 2.500 3.721 2.657 2.481 2.872 0.019 14 0 "[ . 1 . 2]" 1
1567 1 107 SER H 1 107 SER HB3 2.596 2.128 3.167 2.729 2.281 3.620 0.453 20 0 "[ . 1 . 2]" 1
1568 1 107 SER H 1 108 ASP H . 2.608 2.981 2.581 2.542 2.606 0.066 9 0 "[ . 1 . 2]" 1
1569 1 107 SER HA 1 108 ASP H 3.035 2.605 3.537 3.079 2.371 3.335 0.234 11 0 "[ . 1 . 2]" 1
1570 1 107 SER HA 1 108 ASP H 3.488 2.859 4.256 3.588 3.577 3.596 . 0 0 "[ . 1 . 2]" 1
1571 1 107 SER HA 1 109 LEU H 2.692 2.310 3.137 2.806 2.796 2.825 . 0 0 "[ . 1 . 2]" 1
1572 1 107 SER HA 1 110 ARG H 2.886 2.477 3.363 3.047 2.991 3.245 . 0 0 "[ . 1 . 2]" 1
1573 1 107 SER HA 1 111 VAL H 3.739 3.209 4.357 3.898 3.841 3.944 . 0 0 "[ . 1 . 2]" 1
1574 1 107 SER HA 1 110 ARG H 3.410 2.795 4.161 3.326 3.220 3.741 . 0 0 "[ . 1 . 2]" 1
1575 1 107 SER HA 1 110 ARG QB 2.841 2.328 3.466 2.801 2.605 3.087 . 0 0 "[ . 1 . 2]" 1
1576 1 107 SER HB3 1 108 ASP H 2.760 2.369 3.216 2.753 2.428 3.536 0.320 11 0 "[ . 1 . 2]" 1
1577 1 108 ASP H 1 108 ASP HA 2.722 2.336 3.172 2.828 2.809 2.879 . 0 0 "[ . 1 . 2]" 1
1578 1 108 ASP H 1 108 ASP HA 2.907 2.383 3.547 2.723 2.709 2.765 . 0 0 "[ . 1 . 2]" 1
1579 1 108 ASP H 1 108 ASP HB2 2.839 2.436 3.308 2.429 2.234 2.865 0.202 8 0 "[ . 1 . 2]" 1
1580 1 108 ASP H 1 108 ASP HB3 2.598 2.230 3.027 2.857 2.508 3.558 0.531 6 2 "[ .+ 1 - . 2]" 1
1581 1 108 ASP H 1 110 ARG H 2.790 2.394 3.251 2.664 2.590 2.722 . 0 0 "[ . 1 . 2]" 1
1582 1 108 ASP HA 1 109 LEU H 3.581 3.073 4.173 3.554 3.526 3.573 . 0 0 "[ . 1 . 2]" 1
1583 1 108 ASP HA 1 110 ARG H 5.077 4.357 5.916 4.288 4.169 4.340 0.188 8 0 "[ . 1 . 2]" 1
1584 1 108 ASP HA 1 111 VAL H 3.825 3.283 4.457 3.390 3.324 3.481 . 0 0 "[ . 1 . 2]" 1
1585 1 108 ASP HA 1 111 VAL MG2 2.724 2.548 3.324 2.476 2.461 2.486 0.087 16 0 "[ . 1 . 2]" 1
1586 1 108 ASP HB2 1 109 LEU H 3.422 2.937 3.988 3.624 2.609 3.938 0.328 20 0 "[ . 1 . 2]" 1
1587 1 108 ASP HB3 1 109 LEU H 3.090 2.652 3.601 2.799 2.572 3.915 0.314 20 0 "[ . 1 . 2]" 1
1588 1 109 LEU H 1 109 LEU HA 2.970 2.434 3.624 2.844 2.831 2.871 . 0 0 "[ . 1 . 2]" 1
1589 1 109 LEU H 1 109 LEU HB2 2.625 2.253 3.059 2.293 2.240 2.340 0.013 5 0 "[ . 1 . 2]" 1
1590 1 109 LEU H 1 109 LEU HB3 2.672 2.293 3.114 2.832 2.765 3.001 . 0 0 "[ . 1 . 2]" 1
1591 1 109 LEU H 1 109 LEU MD1 3.981 3.263 4.857 3.713 3.528 3.800 . 0 0 "[ . 1 . 2]" 1
1592 1 109 LEU H 1 109 LEU QD 3.234 2.775 3.769 3.499 3.376 3.565 . 0 0 "[ . 1 . 2]" 1
1593 1 109 LEU H 1 109 LEU MD2 4.216 3.455 5.144 4.208 4.157 4.262 . 0 0 "[ . 1 . 2]" 1
1594 1 109 LEU H 1 109 LEU HG 3.828 3.285 4.461 4.532 4.518 4.553 0.092 2 0 "[ . 1 . 2]" 1
1595 1 109 LEU H 1 110 ARG H 2.732 2.345 3.184 2.694 2.617 2.753 . 0 0 "[ . 1 . 2]" 1
1596 1 109 LEU H 1 111 VAL H 4.856 4.203 5.659 4.194 4.168 4.245 0.035 9 0 "[ . 1 . 2]" 1
1597 1 109 LEU H 1 112 TYR QD 5.232 4.367 6.289 4.503 4.428 4.605 . 0 0 "[ . 1 . 2]" 1
1598 1 109 LEU H 1 112 TYR QR 4.616 3.962 5.379 4.316 4.235 4.411 . 0 0 "[ . 1 . 2]" 1
1599 1 109 LEU HA 1 109 LEU MD1 2.552 2.092 3.114 2.134 2.105 2.156 . 0 0 "[ . 1 . 2]" 1
1600 1 109 LEU HA 1 109 LEU MD2 3.939 3.230 4.804 3.755 3.743 3.766 . 0 0 "[ . 1 . 2]" 1
1601 1 109 LEU HA 1 109 LEU HG 3.218 2.637 3.926 2.728 2.606 2.818 0.031 5 0 "[ . 1 . 2]" 1
1602 1 109 LEU HA 1 110 ARG H 3.660 3.000 4.465 3.549 3.528 3.561 . 0 0 "[ . 1 . 2]" 1
1603 1 109 LEU HA 1 111 VAL MG1 3.836 3.144 4.680 3.580 3.554 3.605 . 0 0 "[ . 1 . 2]" 1
1604 1 109 LEU HA 1 111 VAL MG2 4.062 3.329 4.956 4.743 4.711 4.819 . 0 0 "[ . 1 . 2]" 1
1605 1 109 LEU HA 1 112 TYR H 3.406 2.792 4.156 3.275 3.203 3.440 . 0 0 "[ . 1 . 2]" 1
1606 1 109 LEU HA 1 112 TYR H 2.497 2.143 2.910 2.758 2.737 2.805 . 0 0 "[ . 1 . 2]" 1
1607 1 109 LEU HA 1 112 TYR QD 2.735 2.283 3.288 2.241 2.214 2.286 0.069 13 0 "[ . 1 . 2]" 1
1608 1 109 LEU HA 1 112 TYR QE 3.430 2.863 4.123 3.942 3.882 4.007 . 0 0 "[ . 1 . 2]" 1
1609 1 109 LEU HB2 1 110 ARG H 3.751 3.219 4.371 3.719 3.672 3.787 . 0 0 "[ . 1 . 2]" 1
1610 1 109 LEU QD 1 110 ARG H 4.237 3.636 4.937 4.112 4.054 4.285 . 0 0 "[ . 1 . 2]" 1
1611 1 109 LEU QD 1 112 TYR H 3.263 2.800 3.803 3.408 3.378 3.432 . 0 0 "[ . 1 . 2]" 1
1612 1 109 LEU QD 1 112 TYR HA 3.358 2.752 4.097 3.567 3.543 3.596 . 0 0 "[ . 1 . 2]" 1
1613 1 109 LEU QD 1 113 LEU H 3.884 3.333 4.526 3.827 3.657 4.074 . 0 0 "[ . 1 . 2]" 1
1614 1 109 LEU QD 1 117 THR HA 3.123 2.560 3.810 3.809 3.716 3.874 0.064 11 0 "[ . 1 . 2]" 1
1615 1 109 LEU QD 1 117 THR MG 2.723 2.231 3.323 2.300 2.176 2.520 0.055 17 0 "[ . 1 . 2]" 1
1616 1 109 LEU MD1 1 112 TYR QD 3.310 2.763 3.979 3.143 3.080 3.208 . 0 0 "[ . 1 . 2]" 1
1617 1 109 LEU MD1 1 112 TYR QE 3.738 3.120 4.494 3.830 3.780 3.846 . 0 0 "[ . 1 . 2]" 1
1618 1 109 LEU MD1 1 117 THR MG 3.678 3.014 4.488 4.185 4.006 4.528 0.040 10 0 "[ . 1 . 2]" 1
1619 1 109 LEU MD2 1 118 PRO HD2 4.007 3.284 4.889 3.201 2.552 3.266 0.732 17 1 "[ . 1 . + 2]" 1
1620 1 109 LEU MD2 1 118 PRO HD2 4.102 3.362 5.005 3.155 2.533 3.221 0.829 17 1 "[ . 1 . + 2]" 1
1621 1 109 LEU HG 1 117 THR MG 3.317 2.719 4.047 2.992 2.748 3.414 . 0 0 "[ . 1 . 2]" 1
1622 1 110 ARG H 1 110 ARG QB 2.325 . 2.709 2.272 2.101 2.534 . 0 0 "[ . 1 . 2]" 1
1623 1 110 ARG H 1 110 ARG HD2 4.390 3.767 5.116 5.017 3.882 5.987 0.871 8 3 "[ . *+ 1 . -]" 1
1624 1 110 ARG H 1 111 VAL H 3.174 2.724 3.591 2.741 2.627 2.783 0.097 2 0 "[ . 1 . 2]" 1
1625 1 110 ARG H 1 111 VAL MG2 3.778 3.242 4.403 4.111 3.948 4.171 . 0 0 "[ . 1 . 2]" 1
1626 1 110 ARG H 1 112 TYR H 4.553 3.907 5.306 4.138 4.109 4.168 . 0 0 "[ . 1 . 2]" 1
1627 1 110 ARG H 1 117 THR MG 3.782 3.246 4.407 3.817 3.720 4.186 . 0 0 "[ . 1 . 2]" 1
1628 1 110 ARG HA 1 111 VAL H 3.817 3.276 4.448 3.557 3.536 3.565 . 0 0 "[ . 1 . 2]" 1
1629 1 110 ARG HA 1 113 LEU H 2.814 2.621 3.279 3.281 2.976 3.383 0.104 8 0 "[ . 1 . 2]" 1
1630 1 110 ARG HA 1 114 GLY H 2.872 2.465 3.347 3.482 3.425 3.544 0.197 13 0 "[ . 1 . 2]" 1
1631 1 110 ARG HA 1 117 THR MG 3.486 3.025 4.253 3.060 2.964 3.386 0.061 5 0 "[ . 1 . 2]" 1
1632 1 110 ARG QB 1 111 VAL H 2.356 2.022 2.745 2.323 2.276 2.393 . 0 0 "[ . 1 . 2]" 1
1633 1 110 ARG QB 1 117 THR MG 3.338 2.736 4.073 3.682 3.400 4.117 0.044 5 0 "[ . 1 . 2]" 1
1634 1 110 ARG HD3 1 114 GLY H 5.296 4.545 6.171 6.295 3.860 6.948 0.777 5 8 "[ * + ***1 -*. *]" 1
1635 1 110 ARG HG2 1 111 VAL H 4.531 3.889 5.280 4.093 3.224 5.061 0.665 9 3 "[ - . +1 *. 2]" 1
1636 1 110 ARG HG3 1 114 GLY H 3.763 3.229 4.385 4.368 3.831 4.769 0.384 16 0 "[ . 1 . 2]" 1
1637 1 111 VAL H 1 111 VAL HA 2.776 2.461 3.235 2.835 2.822 2.845 . 0 0 "[ . 1 . 2]" 1
1638 1 111 VAL H 1 111 VAL HB 2.495 2.045 3.044 2.579 2.556 2.612 . 0 0 "[ . 1 . 2]" 1
1639 1 111 VAL H 1 111 VAL MG1 3.177 2.985 3.702 3.779 3.771 3.790 0.088 16 0 "[ . 1 . 2]" 1
1640 1 111 VAL H 1 111 VAL MG2 2.328 2.158 2.713 2.049 2.035 2.061 0.123 19 0 "[ . 1 . 2]" 1
1641 1 111 VAL H 1 112 TYR H 2.915 2.502 3.390 2.693 2.659 2.750 . 0 0 "[ . 1 . 2]" 1
1642 1 111 VAL H 1 112 TYR QD 4.368 3.749 4.881 4.212 4.117 4.338 . 0 0 "[ . 1 . 2]" 1
1643 1 111 VAL H 1 112 TYR QE 4.925 4.111 5.920 5.521 5.405 5.599 . 0 0 "[ . 1 . 2]" 1
1644 1 111 VAL H 1 113 LEU H 4.395 3.772 4.975 4.349 4.270 4.418 . 0 0 "[ . 1 . 2]" 1
1645 1 111 VAL H 1 114 GLY H 4.685 4.021 5.459 5.051 5.009 5.087 . 0 0 "[ . 1 . 2]" 1
1646 1 111 VAL HA 1 111 VAL MG1 2.649 2.326 3.232 2.329 2.320 2.347 0.006 8 0 "[ . 1 . 2]" 1
1647 1 111 VAL HA 1 111 VAL MG2 2.499 2.161 3.049 2.338 2.314 2.384 . 0 0 "[ . 1 . 2]" 1
1648 1 111 VAL HA 1 112 TYR H 3.470 3.117 4.044 3.545 3.524 3.564 . 0 0 "[ . 1 . 2]" 1
1649 1 111 VAL HA 1 114 GLY H 5.424 4.655 6.321 4.432 4.410 4.464 0.245 19 0 "[ . 1 . 2]" 1
1650 1 111 VAL HB 1 112 TYR H 2.665 2.287 3.106 2.733 2.654 2.771 . 0 0 "[ . 1 . 2]" 1
1651 1 111 VAL HB 1 112 TYR QD 3.954 3.300 4.753 3.338 3.282 3.425 0.018 12 0 "[ . 1 . 2]" 1
1652 1 111 VAL HB 1 112 TYR QE 4.077 3.403 4.901 3.806 3.720 3.853 . 0 0 "[ . 1 . 2]" 1
1653 1 111 VAL MG1 1 112 TYR H 3.876 3.177 4.729 3.583 3.559 3.614 . 0 0 "[ . 1 . 2]" 1
1654 1 111 VAL MG1 1 112 TYR QR 4.516 3.701 5.510 3.586 3.551 3.612 0.150 10 0 "[ . 1 . 2]" 1
1655 1 111 VAL MG2 1 112 TYR H 3.761 3.082 4.589 3.863 3.806 3.899 . 0 0 "[ . 1 . 2]" 1
1656 1 111 VAL MG2 1 112 TYR HA 3.794 3.110 4.629 4.289 4.066 4.508 . 0 0 "[ . 1 . 2]" 1
1657 1 111 VAL MG2 1 112 TYR QR 4.434 3.634 5.410 4.151 4.098 4.207 . 0 0 "[ . 1 . 2]" 1
1658 1 111 VAL MG2 1 114 GLY H 4.125 3.540 4.807 4.188 4.118 4.269 . 0 0 "[ . 1 . 2]" 1
1659 1 112 TYR H 1 112 TYR HA 2.830 2.319 3.453 2.970 2.968 2.973 . 0 0 "[ . 1 . 2]" 1
1660 1 112 TYR H 1 112 TYR HB2 2.797 2.400 3.259 2.447 2.423 2.486 . 0 0 "[ . 1 . 2]" 1
1661 1 112 TYR H 1 112 TYR HB3 3.186 2.734 3.713 3.665 3.657 3.677 . 0 0 "[ . 1 . 2]" 1
1662 1 112 TYR H 1 112 TYR QR 2.548 2.187 2.969 2.552 2.492 2.604 . 0 0 "[ . 1 . 2]" 1
1663 1 112 TYR H 1 113 LEU H 2.309 2.113 2.691 2.466 2.414 2.497 . 0 0 "[ . 1 . 2]" 1
1664 1 112 TYR H 1 113 LEU HB2 4.023 3.452 4.687 4.786 4.742 4.821 0.134 1 0 "[ . 1 . 2]" 1
1665 1 112 TYR H 1 113 LEU HG 4.227 3.627 4.926 4.676 4.507 4.844 . 0 0 "[ . 1 . 2]" 1
1666 1 112 TYR H 1 114 GLY H 3.845 3.318 4.481 4.054 4.000 4.117 . 0 0 "[ . 1 . 2]" 1
1667 1 112 TYR HA 1 112 TYR QD 3.292 2.698 4.017 2.702 2.651 2.735 0.047 8 0 "[ . 1 . 2]" 1
1668 1 112 TYR HA 1 113 LEU H 3.031 2.669 3.532 3.573 3.566 3.581 0.049 15 0 "[ . 1 . 2]" 1
1669 1 112 TYR HA 1 114 GLY H 4.101 3.519 4.779 4.260 4.161 4.339 . 0 0 "[ . 1 . 2]" 1
1670 1 112 TYR HB2 1 113 LEU H 2.787 2.392 3.248 2.403 2.384 2.432 0.008 19 0 "[ . 1 . 2]" 1
1671 1 112 TYR HB2 1 113 LEU MD2 3.668 3.006 4.475 4.172 3.868 4.490 0.015 15 0 "[ . 1 . 2]" 1
1672 1 112 TYR HB2 1 114 GLY H 5.257 4.512 6.126 4.995 4.928 5.076 . 0 0 "[ . 1 . 2]" 1
1673 1 112 TYR HB3 1 113 LEU H 3.114 2.672 3.629 3.408 3.365 3.478 . 0 0 "[ . 1 . 2]" 1
1674 1 112 TYR QD 1 113 LEU H 3.371 3.168 3.928 4.007 3.979 4.029 0.101 12 0 "[ . 1 . 2]" 1
1675 1 113 LEU H 1 113 LEU HA 2.708 2.324 3.156 2.990 2.985 2.995 . 0 0 "[ . 1 . 2]" 1
1676 1 113 LEU H 1 113 LEU HB2 2.597 2.229 3.026 2.463 2.396 2.522 . 0 0 "[ . 1 . 2]" 1
1677 1 113 LEU H 1 113 LEU HB3 3.010 2.583 3.508 3.674 3.642 3.701 0.193 16 0 "[ . 1 . 2]" 1
1678 1 113 LEU H 1 113 LEU MD1 4.010 3.287 4.893 3.820 3.695 3.957 . 0 0 "[ . 1 . 2]" 1
1679 1 113 LEU H 1 113 LEU QD 2.784 2.389 3.244 3.348 3.274 3.403 0.159 8 0 "[ . 1 . 2]" 1
1680 1 113 LEU H 1 113 LEU MD2 3.685 3.020 4.496 3.713 3.491 3.909 . 0 0 "[ . 1 . 2]" 1
1681 1 113 LEU H 1 113 LEU HG 2.620 2.248 3.053 2.710 2.554 2.801 . 0 0 "[ . 1 . 2]" 1
1682 1 113 LEU H 1 114 GLY H 2.665 2.287 2.848 2.944 2.919 2.992 0.144 16 0 "[ . 1 . 2]" 1
1683 1 113 LEU H 1 114 GLY HA2 3.787 3.250 4.413 4.495 4.466 4.531 0.118 15 0 "[ . 1 . 2]" 1
1684 1 113 LEU H 1 114 GLY HA3 4.271 3.665 4.977 4.862 4.838 4.876 . 0 0 "[ . 1 . 2]" 1
1685 1 113 LEU H 1 117 THR MG 4.008 3.440 4.671 4.094 3.913 4.641 . 0 0 "[ . 1 . 2]" 1
1686 1 113 LEU HA 1 113 LEU MD1 3.527 2.891 4.303 3.815 3.781 3.843 . 0 0 "[ . 1 . 2]" 1
1687 1 113 LEU HA 1 113 LEU QD 2.142 . 2.613 2.118 2.073 2.167 . 0 0 "[ . 1 . 2]" 1
1688 1 113 LEU HA 1 113 LEU MD2 2.145 . 2.617 2.128 2.082 2.179 . 0 0 "[ . 1 . 2]" 1
1689 1 113 LEU HA 1 113 LEU HG 2.972 2.436 3.626 3.013 2.857 3.194 . 0 0 "[ . 1 . 2]" 1
1690 1 113 LEU HA 1 114 GLY H 3.379 2.900 3.938 2.844 2.792 2.879 0.108 5 0 "[ . 1 . 2]" 1
1691 1 113 LEU HB2 1 114 GLY H 3.872 3.323 4.512 4.166 4.138 4.198 . 0 0 "[ . 1 . 2]" 1
1692 1 113 LEU HB2 1 117 THR H 4.298 3.689 5.008 4.674 4.486 4.831 . 0 0 "[ . 1 . 2]" 1
1693 1 113 LEU HB3 1 114 GLY H 4.771 4.094 5.560 4.420 4.398 4.438 . 0 0 "[ . 1 . 2]" 1
1694 1 113 LEU QD 1 116 SER HB3 3.376 2.767 4.119 3.854 2.922 4.644 0.525 17 1 "[ . 1 . + 2]" 1
1695 1 113 LEU QD 1 117 THR H 3.780 3.244 4.404 4.500 4.460 4.523 0.119 10 0 "[ . 1 . 2]" 1
1696 1 113 LEU QD 1 117 THR HA 2.494 2.044 3.043 3.128 3.054 3.178 0.135 10 0 "[ . 1 . 2]" 1
1697 1 113 LEU MD1 1 117 THR HA 3.011 2.468 3.674 2.913 2.670 2.962 . 0 0 "[ . 1 . 2]" 1
1698 1 113 LEU MD1 1 118 PRO HD2 3.539 2.900 4.318 3.586 3.439 3.882 . 0 0 "[ . 1 . 2]" 1
1699 1 114 GLY H 1 114 GLY HA2 2.509 2.153 2.924 2.848 2.835 2.857 . 0 0 "[ . 1 . 2]" 1
1700 1 114 GLY H 1 114 GLY HA3 2.359 2.025 2.749 2.340 2.333 2.345 . 0 0 "[ . 1 . 2]" 1
1701 1 114 GLY H 1 117 THR MG 5.500 5.000 1004.500 5.113 4.981 5.570 0.019 1 0 "[ . 1 . 2]" 1
1702 1 114 GLY HA2 1 115 ALA H 3.528 3.028 4.111 2.900 2.881 2.918 0.147 7 0 "[ . 1 . 2]" 1
1703 1 114 GLY HA3 1 115 ALA H 3.973 3.410 4.630 3.582 3.576 3.591 . 0 0 "[ . 1 . 2]" 1
1704 1 115 ALA H 1 115 ALA HA 2.993 2.569 3.488 2.939 2.927 2.950 . 0 0 "[ . 1 . 2]" 1
1705 1 115 ALA H 1 115 ALA MB 2.613 2.242 3.045 2.694 2.660 2.727 . 0 0 "[ . 1 . 2]" 1
1706 1 115 ALA HA 1 116 SER H 3.540 2.901 4.319 3.594 3.587 3.599 . 0 0 "[ . 1 . 2]" 1
1707 1 115 ALA HA 1 117 THR H 3.818 3.277 3.909 3.992 3.942 4.040 0.131 7 0 "[ . 1 . 2]" 1
1708 1 115 ALA MB 1 116 SER H 2.806 2.408 3.270 2.340 2.308 2.367 0.100 7 0 "[ . 1 . 2]" 1
1709 1 115 ALA MB 1 117 THR H 4.790 4.111 5.582 4.255 4.216 4.290 . 0 0 "[ . 1 . 2]" 1
1710 1 116 SER H 1 116 SER HA 3.387 2.776 4.133 2.988 2.982 2.992 . 0 0 "[ . 1 . 2]" 1
1711 1 116 SER HA 1 117 THR H 3.287 2.821 3.830 2.924 2.874 2.956 . 0 0 "[ . 1 . 2]" 1
1712 1 117 THR H 1 117 THR HA 2.796 2.292 3.411 2.878 2.832 2.903 . 0 0 "[ . 1 . 2]" 1
1713 1 117 THR H 1 117 THR HB 2.609 2.138 3.183 3.029 2.876 3.095 . 0 0 "[ . 1 . 2]" 1
1714 1 117 THR H 1 117 THR MG 3.794 3.256 4.421 3.624 3.581 3.704 . 0 0 "[ . 1 . 2]" 1
1715 1 117 THR HA 1 118 PRO HD2 2.085 . 2.544 2.327 2.282 2.792 0.248 17 0 "[ . 1 . 2]" 1
1716 1 117 THR HB 1 118 PRO HD2 3.383 2.773 4.127 4.213 3.928 4.357 0.230 18 0 "[ . 1 . 2]" 1
1717 1 117 THR MG 1 118 PRO HD2 . 2.507 2.839 2.588 2.226 2.787 0.281 17 0 "[ . 1 . 2]" 1
1718 1 118 PRO HA 1 118 PRO HD3 3.233 2.650 3.945 3.792 3.756 3.969 0.024 17 0 "[ . 1 . 2]" 1
1719 1 118 PRO HA 1 119 ASP H 2.168 . 2.526 2.632 2.592 2.649 0.123 9 0 "[ . 1 . 2]" 1
1720 1 118 PRO HB2 1 119 ASP H 2.643 2.268 3.080 2.199 2.162 2.238 0.106 10 0 "[ . 1 . 2]" 1
1721 1 118 PRO HB3 1 120 LEU H 4.378 3.757 5.102 4.534 3.953 5.117 0.015 2 0 "[ . 1 . 2]" 1
1722 1 118 PRO HB3 1 120 LEU MD2 3.064 2.511 3.738 2.881 2.735 3.052 . 0 0 "[ . 1 . 2]" 1
1723 1 118 PRO HB3 1 119 ASP H 2.856 2.451 3.328 3.404 3.386 3.462 0.134 17 0 "[ . 1 . 2]" 1
1724 1 118 PRO HG3 1 120 LEU MD2 3.651 2.992 4.454 3.991 3.735 4.291 . 0 0 "[ . 1 . 2]" 1
1725 1 119 ASP H 1 119 ASP HA . 2.866 3.262 2.995 2.980 3.006 . 0 0 "[ . 1 . 2]" 1
1726 1 119 ASP H 1 119 ASP HB2 2.348 2.015 2.736 2.734 2.657 2.781 0.045 15 0 "[ . 1 . 2]" 1
1727 1 119 ASP H 1 119 ASP HB3 2.285 . 2.663 2.706 2.678 2.721 0.058 15 0 "[ . 1 . 2]" 1
1728 1 119 ASP H 1 120 LEU H 4.575 3.926 5.331 4.198 3.940 4.424 . 0 0 "[ . 1 . 2]" 1
1729 1 119 ASP H 1 120 LEU MD2 3.938 3.380 4.589 4.708 4.587 4.783 0.194 9 0 "[ . 1 . 2]" 1
1730 1 119 ASP HA 1 120 LEU H 2.359 2.025 2.749 2.192 2.123 2.262 . 0 0 "[ . 1 . 2]" 1
1731 1 119 ASP HA 1 120 LEU HG 3.583 2.937 4.372 3.887 3.525 4.173 . 0 0 "[ . 1 . 2]" 1
1732 1 119 ASP HB2 1 120 LEU H 4.592 3.941 5.351 4.496 4.322 4.613 . 0 0 "[ . 1 . 2]" 1
1733 1 119 ASP HB3 1 120 LEU H 4.273 3.667 4.979 4.216 4.027 4.344 . 0 0 "[ . 1 . 2]" 1
1734 1 120 LEU H 1 120 LEU HA 3.164 2.715 3.405 2.902 2.835 2.977 . 0 0 "[ . 1 . 2]" 1
1735 1 120 LEU H 1 120 LEU HB2 2.834 2.432 3.302 2.513 2.460 2.582 . 0 0 "[ . 1 . 2]" 1
1736 1 120 LEU H 1 120 LEU HB3 3.389 2.908 3.949 3.638 3.612 3.704 . 0 0 "[ . 1 . 2]" 1
1737 1 120 LEU H 1 120 LEU MD1 3.358 2.882 3.913 3.545 3.455 3.722 . 0 0 "[ . 1 . 2]" 1
1738 1 120 LEU H 1 120 LEU MD2 3.378 2.899 3.936 3.404 3.305 3.595 . 0 0 "[ . 1 . 2]" 1
1739 1 120 LEU H 1 120 LEU HG 2.454 2.106 2.860 2.203 2.075 2.479 0.031 8 0 "[ . 1 . 2]" 1
1740 1 120 LEU H 1 121 GLN H 4.632 3.975 5.398 4.596 4.532 4.641 . 0 0 "[ . 1 . 2]" 1
1741 1 120 LEU HA 1 120 LEU MD1 3.866 3.169 4.717 3.835 3.811 3.883 . 0 0 "[ . 1 . 2]" 1
1742 1 120 LEU HA 1 120 LEU MD2 2.473 2.012 2.762 2.144 2.110 2.211 . 0 0 "[ . 1 . 2]" 1
1743 1 120 LEU HA 1 121 GLN H 1.995 . 2.325 2.187 2.167 2.211 . 0 0 "[ . 1 . 2]" 1
1744 1 120 LEU HB2 1 121 GLN H 3.708 3.182 4.321 4.071 4.026 4.115 . 0 0 "[ . 1 . 2]" 1
1745 1 120 LEU HB3 1 121 GLN H 3.251 2.790 3.788 3.116 2.975 3.262 . 0 0 "[ . 1 . 2]" 1
1746 1 120 LEU MD1 1 121 GLN HA 4.000 3.500 1003.000 6.123 6.090 6.149 . 0 0 "[ . 1 . 2]" 1
1747 1 120 LEU MD2 1 121 GLN H 3.157 2.945 3.678 3.505 3.335 3.723 0.045 17 0 "[ . 1 . 2]" 1
1748 1 120 LEU MD2 1 121 GLN HA 4.000 3.500 1003.000 5.634 5.522 5.766 . 0 0 "[ . 1 . 2]" 1
1749 1 121 GLN H 1 121 GLN HA 2.852 2.642 3.323 2.994 2.985 2.999 . 0 0 "[ . 1 . 2]" 1
1750 1 121 GLN H 1 121 GLN HB2 2.623 2.251 3.057 2.849 2.806 2.885 . 0 0 "[ . 1 . 2]" 1
1751 1 121 GLN H 1 121 GLN HB3 3.263 2.800 3.802 3.862 3.850 3.880 0.078 20 0 "[ . 1 . 2]" 1
1752 1 121 GLN H 1 121 GLN QG 2.646 2.271 3.083 2.580 2.507 2.702 . 0 0 "[ . 1 . 2]" 1
1753 1 121 GLN HA 1 121 GLN HE21 4.505 3.866 5.250 3.849 3.823 3.961 0.043 8 0 "[ . 1 . 2]" 1
1754 1 121 GLN HA 1 121 GLN HE22 4.476 3.841 5.216 3.799 3.760 3.835 0.081 11 0 "[ . 1 . 2]" 1
1755 1 121 GLN HA 1 121 GLN QG 2.819 2.311 3.439 3.133 3.118 3.145 . 0 0 "[ . 1 . 2]" 1
1756 1 121 GLN HB2 1 121 GLN HE21 4.757 4.082 5.543 4.486 4.470 4.507 . 0 0 "[ . 1 . 2]" 1
1757 1 121 GLN HB2 1 121 GLN HE22 5.447 4.675 6.347 5.274 5.266 5.279 . 0 0 "[ . 1 . 2]" 1
1758 1 121 GLN HB3 1 121 GLN HE21 4.489 3.852 5.231 4.464 4.437 4.507 . 0 0 "[ . 1 . 2]" 1
1759 1 121 GLN HB3 1 121 GLN HE22 5.383 4.620 6.273 4.674 4.639 4.720 . 0 0 "[ . 1 . 2]" 1
1760 1 121 GLN HE21 1 121 GLN QG 2.770 2.378 3.228 2.241 2.236 2.245 0.142 7 0 "[ . 1 . 2]" 1
1761 1 121 GLN HE22 1 121 GLN QG 3.172 2.722 3.696 3.290 3.280 3.295 . 0 0 "[ . 1 . 2]" 1
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